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2-Nitro-5-[(Phenylacetyl)amino]benzoic acid

PropertiesImage
MNX_IDMNXM165988 Image of MNXM165988
referencesabiorkM:23243
formulaC15H12N2O5
global charge0
mol weight300.27
InChIKeyQHVQEQRGDKOHHC-UHFFFAOYSA-N
InChIInChI=1S/C15H12N2O5/c18-14(8-10-4-2-1-3-5-10)16-11-6-7-13(17(21)22)12(9-11)15(19)20/h1-7,9H,8H2,(H,16,18)(H,19,20)
SMILESO=C(O)C1=C([N+](=O)[O-])C=CC(N=C(O)CC2=CC=CC=C2)=C1
MNX internals
InChI (mnx)InChI=1/C15H12N2O5/c18-14(8-10-4-2-1-3-5-10)16-11-6-7-13(17(21)22)12(9-11)15(19)20/h1-7,9H,8H2,(H,16,18)(H,19,20) Image of MNXM165988
SMILES (mnx)[CH:1]1=[CH:2][CH:4]=[C:10]([CH2:8][C:14](=[N:16][C:11]2=[CH:9][C:12]([C:15](=[O:19])[OH:20])=[C:13]([N+:17]([O-:21])=[O:22])[CH:7]=[CH:6]2)[OH:18])[CH:5]=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

sabiork.compound:23243
sabiorkM:23243
QHVQEQRGDKOHHC-UHFFFAOYSA-N
2-Nitro-5-[(Phenylacetyl)amino]benzoic acid