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

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

Systemtic Name:3-[6-nitro-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]benzoic acid
Openeye Name:3-(6-nitro-2,3-dioxo-4H-quinoxalin-1-yl)benzoic acid
CAS Name:3-(6-nitro-2,3-dioxo-4H-quinoxalin-1-yl)benzoic acid
IUPAC Name:3-(6-nitro-2,3-dioxo-4H-quinoxalin-1-yl)benzoic acid
Traditional Name:3-(2,3-diketo-6-nitro-4H-quinoxalin-1-yl)benzoic acid
Formula: C15H9N3O6
MolecularWeight: 327.24846
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C3=C(C=C(C=C3)[N+](=O)[O-])NC(=O)C2=O)C(=O)O


Isomeric SMILES

C1=CC(=CC(=C1)N2C3=C(C=C(C=C3)[N+](=O)[O-])NC(=O)C2=O)C(=O)O


InChI

InChI=1S/C15H9N3O6/c19-13-14(20)17(9-3-1-2-8(6-9)15(21)22)12-5-4-10(18(23)24)7-11(12)16-13/h1-7H,(H,16,19)(H,21,22)


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