[6-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-2,3-dimethoxy-phenyl] benzoate

Systemtic Name: [6-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-2,3-dimethoxy-phenyl] benzoate Openeye Name: [6-[(4-benzhydrylpiperazin-1-yl)methyl]-2,3-dimethoxy-phenyl] benzoate CAS Name: benzoic acid [6-[[4-(diphenylmethyl)-1-piperazinyl]methyl]-2,3-dimethoxyphenyl] ester IUPAC Name: [6-[(4-benzhydrylpiperazin-1-yl)methyl]-2,3-dimethoxyphenyl] benzoate Traditional Name: benzoic acid [6-[(4-benzhydrylpiperazino)methyl]-2,3-dimethoxy-phenyl] ester Formula: C33H34N2O4 MolecularWeight: 522.63406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)OC

InChI

InChI=1S/C33H34N2O4/c1-37-29-19-18-28(31(32(29)38-2)39-33(36)27-16-10-5-11-17-27)24-34-20-22-35(23-21-34)30(25-12-6-3-7-13-25)26-14-8-4-9-15-26/h3-19,30H,20-24H2,1-2H3