2-[1-[2-(3,4-dimethoxyphenyl)ethyl]-6-phenacyl-piperidin-2-yl]-1-phenyl-ethanone

Systemtic Name: 2-[1-[2-(3,4-dimethoxyphenyl)ethyl]-6-phenacyl-piperidin-2-yl]-1-phenyl-ethanone Openeye Name: 2-[1-[2-(3,4-dimethoxyphenyl)ethyl]-6-phenacyl-2-piperidyl]-1-phenyl-ethanone CAS Name: 2-[1-[2-(3,4-dimethoxyphenyl)ethyl]-6-phenacyl-2-piperidinyl]-1-phenylethanone IUPAC Name: 2-[1-[2-(3,4-dimethoxyphenyl)ethyl]-6-phenacylpiperidin-2-yl]-1-phenylethanone Traditional Name: 2-(1-homoveratryl-6-phenacyl-2-piperidyl)-1-phenyl-ethanone Formula: C31H35NO4 MolecularWeight: 485.6139

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(CCCC2CC(=O)C3=CC=CC=C3)CC(=O)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(CCCC2CC(=O)C3=CC=CC=C3)CC(=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C31H35NO4/c1-35-30-17-16-23(20-31(30)36-2)18-19-32-26(21-28(33)24-10-5-3-6-11-24)14-9-15-27(32)22-29(34)25-12-7-4-8-13-25/h3-8,10-13,16-17,20,26-27H,9,14-15,18-19,21-22H2,1-2H3