cyclopropyl-[3-(3,4-dimethoxyphenyl)-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-piperidin-1-yl]methanone

Systemtic Name: cyclopropyl-[3-(3,4-dimethoxyphenyl)-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-piperidin-1-yl]methanone Openeye Name: [3-(4-benzylpiperazine-1-carbonyl)-5-(3,4-dimethoxyphenyl)-1-piperidyl]-cyclopropyl-methanone CAS Name: cyclopropyl-[3-(3,4-dimethoxyphenyl)-5-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-1-piperidinyl]methanone IUPAC Name: [3-(4-benzylpiperazine-1-carbonyl)-5-(3,4-dimethoxyphenyl)piperidin-1-yl]-cyclopropylmethanone Traditional Name: [3-(4-benzylpiperazine-1-carbonyl)-5-(3,4-dimethoxyphenyl)piperidino]-cyclopropyl-methanone Formula: C29H37N3O4 MolecularWeight: 491.62178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(CN(C2)C(=O)C3CC3)C(=O)N4CCN(CC4)CC5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(CN(C2)C(=O)C3CC3)C(=O)N4CCN(CC4)CC5=CC=CC=C5)OC

InChI

InChI=1S/C29H37N3O4/c1-35-26-11-10-23(17-27(26)36-2)24-16-25(20-32(19-24)28(33)22-8-9-22)29(34)31-14-12-30(13-15-31)18-21-6-4-3-5-7-21/h3-7,10-11,17,22,24-25H,8-9,12-16,18-20H2,1-2H3