2-[3-(6-nitro-1-oxidanyl-benzimidazol-2-yl)indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-(6-nitro-1-oxidanyl-benzimidazol-2-yl)indol-1-yl]ethanoic acid Openeye Name: 2-[3-(1-hydroxy-6-nitro-benzimidazol-2-yl)indol-1-yl]acetic acid CAS Name: 2-[3-(1-hydroxy-6-nitro-2-benzimidazolyl)-1-indolyl]acetic acid IUPAC Name: 2-[3-(1-hydroxy-6-nitrobenzimidazol-2-yl)indol-1-yl]acetic acid Traditional Name: 2-[3-(1-hydroxy-6-nitro-benzimidazol-2-yl)indol-1-yl]acetic acid Formula: C17H12N4O5 MolecularWeight: 352.30098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC(=O)O)C3=NC4=C(N3O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC(=O)O)C3=NC4=C(N3O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O5/c22-16(23)9-19-8-12(11-3-1-2-4-14(11)19)17-18-13-6-5-10(21(25)26)7-15(13)20(17)24/h1-8,24H,9H2,(H,22,23)