1-[2-[(3,4-dimethoxyphenyl)methyl]-4-(diphenylmethyl)-2-methyl-piperazin-1-yl]ethyl pyridine-3-carboxylate

Systemtic Name: 1-[2-[(3,4-dimethoxyphenyl)methyl]-4-(diphenylmethyl)-2-methyl-piperazin-1-yl]ethyl pyridine-3-carboxylate Openeye Name: 1-[4-benzhydryl-2-[(3,4-dimethoxyphenyl)methyl]-2-methyl-piperazin-1-yl]ethyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid 1-[2-[(3,4-dimethoxyphenyl)methyl]-4-(diphenylmethyl)-2-methyl-1-piperazinyl]ethyl ester IUPAC Name: 1-[4-benzhydryl-2-[(3,4-dimethoxyphenyl)methyl]-2-methylpiperazin-1-yl]ethyl pyridine-3-carboxylate Traditional Name: nicotinic acid 1-(4-benzhydryl-2-methyl-2-veratryl-piperazino)ethyl ester Formula: C35H39N3O4 MolecularWeight: 565.70186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(N1CCN(CC1(C)CC2=CC(=C(C=C2)OC)OC)C(C3=CC=CC=C3)C4=CC=CC=C4)OC(=O)C5=CN=CC=C5

Isomeric SMILES

CC(N1CCN(CC1(C)CC2=CC(=C(C=C2)OC)OC)C(C3=CC=CC=C3)C4=CC=CC=C4)OC(=O)C5=CN=CC=C5

InChI

InChI=1S/C35H39N3O4/c1-26(42-34(39)30-16-11-19-36-24-30)38-21-20-37(33(28-12-7-5-8-13-28)29-14-9-6-10-15-29)25-35(38,2)23-27-17-18-31(40-3)32(22-27)41-4/h5-19,22,24,26,33H,20-21,23,25H2,1-4H3