ethyl 4-[2-(1H-benzimidazol-2-yl)-4-(phenylmethyl)piperazin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[2-(1H-benzimidazol-2-yl)-4-(phenylmethyl)piperazin-1-yl]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[2-(1H-benzimidazol-2-yl)-4-benzyl-piperazin-1-yl]-4-oxo-butanoate CAS Name: 4-[2-(1H-benzimidazol-2-yl)-4-(phenylmethyl)-1-piperazinyl]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[2-(1H-benzimidazol-2-yl)-4-benzylpiperazin-1-yl]-4-oxobutanoate Traditional Name: 4-[2-(1H-benzimidazol-2-yl)-4-benzyl-piperazino]-4-keto-butyric acid ethyl ester Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N1CCN(CC1C2=NC3=CC=CC=C3N2)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CCC(=O)N1CCN(CC1C2=NC3=CC=CC=C3N2)CC4=CC=CC=C4

InChI

InChI=1S/C24H28N4O3/c1-2-31-23(30)13-12-22(29)28-15-14-27(16-18-8-4-3-5-9-18)17-21(28)24-25-19-10-6-7-11-20(19)26-24/h3-11,21H,2,12-17H2,1H3,(H,25,26)