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DIBOA

PropertiesImage
MNX_IDMNXM1108041 Image of MNXM1108041
referencemetacycM:CPD-6365
formulaC8H6NO4
global charge-1
mol weight180.139
InChIKeyQUBXBHWFQCVXQY-UHFFFAOYSA-N
InChIInChI=1S/C8H6NO4/c10-7-8(11)13-6-4-2-1-3-5(6)9(7)12/h1-4,8,11H/q-1
SMILESO=C1C(O)OC2=C(C=CC=C2)N1[O-]
MNX internals
InChI (mnx)InChI=1/C8H6NO4/c10-7-8(11)13-6-4-2-1-3-5(6)9(7)12/h1-4,8,11H/q-1/t8? Image of MNXM1108041
SMILES (mnx)[CH:1]1=[CH:2][CH:4]=[C:6]2[C:5](=[CH:3]1)[N:9]([O-:12])[C:7](=[O:10])[CH:8]([OH:11])[O:13]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-6365
metacycM:CPD-6365
QUBXBHWFQCVXQY-UHFFFAOYSA-N 		DIBOA
2,4-dihydrozy-2H-1,4-benzoxazin-3(4H)-one