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3-[(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]benzoic acid

3-[(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]benzoic acid

Systemtic Name:3-[(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]benzoic acid
Openeye Name:3-[(3-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]benzoic acid
CAS Name:3-[(3-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]benzoic acid
IUPAC Name:3-[(3-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]benzoic acid
Traditional Name:3-[(4-keto-3-nitro-cyclohexa-2,5-dien-1-ylidene)methylamino]benzoic acid
Formula: C14H10N2O5
MolecularWeight: 286.2396
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC=C2C=CC(=O)C(=C2)[N+](=O)[O-])C(=O)O


Isomeric SMILES

C1=CC(=CC(=C1)NC=C2C=CC(=O)C(=C2)[N+](=O)[O-])C(=O)O


InChI

InChI=1S/C14H10N2O5/c17-13-5-4-9(6-12(13)16(20)21)8-15-11-3-1-2-10(7-11)14(18)19/h1-8,15H,(H,18,19)


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