(2E)-1-cyclopentyl-2-(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3H-benzimidazole-5-carboxylic acid

Systemtic Name: (2E)-1-cyclopentyl-2-(3-nitro-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3H-benzimidazole-5-carboxylic acid Openeye Name: (2E)-1-cyclopentyl-2-(3-nitro-4-oxo-cyclohexa-2,5-dien-1-ylidene)-3H-benzimidazole-5-carboxylic acid CAS Name: (2E)-1-cyclopentyl-2-(3-nitro-4-oxo-1-cyclohexa-2,5-dienylidene)-3H-benzimidazole-5-carboxylic acid IUPAC Name: (2E)-1-cyclopentyl-2-(3-nitro-4-oxocyclohexa-2,5-dien-1-ylidene)-3H-benzimidazole-5-carboxylic acid Traditional Name: (2E)-1-cyclopentyl-2-(4-keto-3-nitro-cyclohexa-2,5-dien-1-ylidene)-3H-benzimidazole-5-carboxylic acid Formula: C19H17N3O5 MolecularWeight: 367.35538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=C(C=C(C=C3)C(=O)O)NC2=C4C=CC(=O)C(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)N\2C3=C(C=C(C=C3)C(=O)O)N/C2=C\4/C=CC(=O)C(=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O5/c23-17-8-6-11(10-16(17)22(26)27)18-20-14-9-12(19(24)25)5-7-15(14)21(18)13-3-1-2-4-13/h5-10,13,20H,1-4H2,(H,24,25)/b18-11+