4-[[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-(1H-benzo[f]benzimidazol-2-yl)phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[3-(1H-benzo[f]benzimidazol-2-yl)anilino]-4-oxo-butanoic acid CAS Name: 4-[3-(1H-benzo[f]benzimidazol-2-yl)anilino]-4-oxobutanoic acid IUPAC Name: 4-[3-(1H-benzo[f]benzimidazol-2-yl)anilino]-4-oxobutanoic acid Traditional Name: 4-[3-(1H-benzo[f]benzimidazol-2-yl)anilino]-4-keto-butyric acid Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C3C(=CC2=C1)NC(=N3)C4=CC(=CC=C4)NC(=O)CCC(=O)O

Isomeric SMILES

C1=CC=C2C=C3C(=CC2=C1)NC(=N3)C4=CC(=CC=C4)NC(=O)CCC(=O)O

InChI

InChI=1S/C21H17N3O3/c25-19(8-9-20(26)27)22-16-7-3-6-15(10-16)21-23-17-11-13-4-1-2-5-14(13)12-18(17)24-21/h1-7,10-12H,8-9H2,(H,22,25)(H,23,24)(H,26,27)