N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[1-(4-pentylphenyl)carbonylpiperidin-4-yl]piperidine-4-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[1-(4-pentylphenyl)carbonylpiperidin-4-yl]piperidine-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[1-(4-pentylbenzoyl)-4-piperidyl]piperidine-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[1-[oxo-(4-pentylphenyl)methyl]-4-piperidinyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[1-(4-pentylbenzoyl)piperidin-4-yl]piperidine-4-carboxamide Traditional Name: 1-[1-(4-amylbenzoyl)-4-piperidyl]-N-homoveratryl-isonipecotamide Formula: C33H47N3O4 MolecularWeight: 549.74398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N2CCC(CC2)N3CCC(CC3)C(=O)NCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N2CCC(CC2)N3CCC(CC3)C(=O)NCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C33H47N3O4/c1-4-5-6-7-25-8-11-28(12-9-25)33(38)36-22-17-29(18-23-36)35-20-15-27(16-21-35)32(37)34-19-14-26-10-13-30(39-2)31(24-26)40-3/h8-13,24,27,29H,4-7,14-23H2,1-3H3,(H,34,37)