6-[2-[4-(4-ethanoylphenyl)piperazin-1-yl]ethyl]-2-oxidanylidene-3H-benzimidazole-1-carboxylic acid

Systemtic Name: 6-[2-[4-(4-ethanoylphenyl)piperazin-1-yl]ethyl]-2-oxidanylidene-3H-benzimidazole-1-carboxylic acid Openeye Name: 6-[2-[4-(4-acetylphenyl)piperazin-1-yl]ethyl]-2-oxo-3H-benzimidazole-1-carboxylic acid CAS Name: 6-[2-[4-(4-acetylphenyl)-1-piperazinyl]ethyl]-2-oxo-3H-benzimidazole-1-carboxylic acid IUPAC Name: 6-[2-[4-(4-acetylphenyl)piperazin-1-yl]ethyl]-2-oxo-3H-benzimidazole-1-carboxylic acid Traditional Name: 6-[2-[4-(4-acetylphenyl)piperazino]ethyl]-2-keto-3H-benzimidazole-1-carboxylic acid Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)CCC3=CC4=C(C=C3)NC(=O)N4C(=O)O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)CCC3=CC4=C(C=C3)NC(=O)N4C(=O)O

InChI

InChI=1S/C22H24N4O4/c1-15(27)17-3-5-18(6-4-17)25-12-10-24(11-13-25)9-8-16-2-7-19-20(14-16)26(22(29)30)21(28)23-19/h2-7,14H,8-13H2,1H3,(H,23,28)(H,29,30)