[2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl] 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoate

Systemtic Name: [2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl] 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoate Openeye Name: [2-(4-benzhydrylpiperazin-1-yl)-2-oxo-ethyl] 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoate CAS Name: 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoic acid [2-[4-(diphenylmethyl)-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-(4-benzhydrylpiperazin-1-yl)-2-oxoethyl] 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoate Traditional Name: 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoic acid [2-(4-benzhydrylpiperazino)-2-keto-ethyl] ester Formula: C31H32N4O3 MolecularWeight: 508.61078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)C2=CC=C(C=C2)C(=O)OCC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=C(N=C(N1)C2=CC=C(C=C2)C(=O)OCC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

InChI=1S/C31H32N4O3/c1-22-23(2)33-30(32-22)26-13-15-27(16-14-26)31(37)38-21-28(36)34-17-19-35(20-18-34)29(24-9-5-3-6-10-24)25-11-7-4-8-12-25/h3-16,29H,17-21H2,1-2H3,(H,32,33)