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2-[[6-nitro-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]methyl]benzoic acid

2-[[6-nitro-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]methyl]benzoic acid

Systemtic Name:2-[[6-nitro-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]methyl]benzoic acid
Openeye Name:2-[(6-nitro-2,3-dioxo-4H-quinoxalin-1-yl)methyl]benzoic acid
CAS Name:2-[(6-nitro-2,3-dioxo-4H-quinoxalin-1-yl)methyl]benzoic acid
IUPAC Name:2-[(6-nitro-2,3-dioxo-4H-quinoxalin-1-yl)methyl]benzoic acid
Traditional Name:2-[(2,3-diketo-6-nitro-4H-quinoxalin-1-yl)methyl]benzoic acid
Formula: C16H11N3O6
MolecularWeight: 341.27504
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C3=C(C=C(C=C3)[N+](=O)[O-])NC(=O)C2=O)C(=O)O


Isomeric SMILES

C1=CC=C(C(=C1)CN2C3=C(C=C(C=C3)[N+](=O)[O-])NC(=O)C2=O)C(=O)O


InChI

InChI=1S/C16H11N3O6/c20-14-15(21)18(8-9-3-1-2-4-11(9)16(22)23)13-6-5-10(19(24)25)7-12(13)17-14/h1-7H,8H2,(H,17,20)(H,22,23)


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