3-(1H-benzimidazol-2-ylcarbamoyl)-5-nitro-benzoic acid

Systemtic Name: 3-(1H-benzimidazol-2-ylcarbamoyl)-5-nitro-benzoic acid Openeye Name: 3-(1H-benzimidazol-2-ylcarbamoyl)-5-nitro-benzoic acid CAS Name: 3-[(1H-benzimidazol-2-ylamino)-oxomethyl]-5-nitrobenzoic acid IUPAC Name: 3-(1H-benzimidazol-2-ylcarbamoyl)-5-nitrobenzoic acid Traditional Name: 3-(1H-benzimidazol-2-ylcarbamoyl)-5-nitro-benzoic acid Formula: C15H10N4O5 MolecularWeight: 326.2637

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C15H10N4O5/c20-13(18-15-16-11-3-1-2-4-12(11)17-15)8-5-9(14(21)22)7-10(6-8)19(23)24/h1-7H,(H,21,22)(H2,16,17,18,20)