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dichlorochromopyrrolate

PropertiesImage
MNX_IDMNXM3261 Image of MNXM3261
referencechebi:59198
formulaC22H11Cl2N3O4
global charge-2
mol weight452.253
InChIKeyOAMCCJASDLMTOO-UHFFFAOYSA-L
InChIInChI=1S/C22H13Cl2N3O4/c23-13-5-1-3-9-11(7-25-17(9)13)15-16(20(22(30)31)27-19(15)21(28)29)12-8-26-18-10(12)4-2-6-14(18)24/h1-8,25-27H,(H,28,29)(H,30,31)/p-2
SMILESO=C([O-])C1=C(C2=CNC3=C2C=CC=C3Cl)C(C2=CNC3=C2C=CC=C3Cl)=C(C(=O)[O-])N1
MNX internals
InChI (mnx)InChI=1/C22H13Cl2N3O4/c23-13-5-1-3-9-11(7-25-17(9)13)15-16(20(22(30)31)27-19(15)21(28)29)12-8-26-18-10(12)4-2-6-14(18)24/h1-8,25-27H,(H,28,29)(H,30,31) Image of MNXM3261
SMILES (mnx)[CH:1]1=[CH:3][C:9]2=[C:17]([C:13]([Cl:23])=[CH:5]1)[NH:25][CH:7]=[C:11]2[C:15]1=[C:19]([C:21]([OH:28])=[O:29])[NH:27][C:20]([C:22]([OH:30])=[O:31])=[C:16]1[C:12]1=[CH:8][NH:26][C:18]2=[C:10]1[CH:4]=[CH:2][CH:6]=[C:14]2[Cl:24]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:59198
chebi:59198
OAMCCJASDLMTOO-UHFFFAOYSA-L 		dichlorochromopyrrolate
3,4-bis(7-chloro-1H-indol-3-yl)-1H-pyrrole-2,5-dicarboxylate

kegg.compound:C19698
keggC:C19698
OAMCCJASDLMTOO-UHFFFAOYSA-N 		3,4-Bis(7-chloroindol-3-yl)pyrrole-2,5-dicarboxylate
Dichlorochromopyrrolate

seed.compound:cpd20946
seedM:cpd20946
OAMCCJASDLMTOO-UHFFFAOYSA-L 		3,4-Bis(7-chloroindol-3-yl)pyrrole-2,5-dicarboxylate
Dichlorochromopyrrolate
dichlorochromopyrrolate
dichlorochromopyrrolic acid

metacyc.compound:CPD-11754
metacycM:CPD-11754
OAMCCJASDLMTOO-UHFFFAOYSA-L 		dichlorochromopyrrolate
dichlorochromopyrrolic acid

CHEBI:59196
chebi:59196
OAMCCJASDLMTOO-UHFFFAOYSA-N 		dichlorochromopyrrolic acid
3,4-bis(7-chloro-1H-indol-3-yl)-1H-pyrrole-2,5-dicarboxylic acid

keggC:M_C19698
seedM:M_cpd20946 		secondary/obsolete/fantasy identifier