phenyl 1-[1-(3,5-dimethylphenyl)carbonyl-2-(1-phenylethyl)piperidin-4-yl]piperidine-4-carboxylate

Systemtic Name: phenyl 1-[1-(3,5-dimethylphenyl)carbonyl-2-(1-phenylethyl)piperidin-4-yl]piperidine-4-carboxylate Openeye Name: phenyl 1-[1-(3,5-dimethylbenzoyl)-2-(1-phenylethyl)-4-piperidyl]piperidine-4-carboxylate CAS Name: 1-[1-[(3,5-dimethylphenyl)-oxomethyl]-2-(1-phenylethyl)-4-piperidinyl]-4-piperidinecarboxylic acid phenyl ester IUPAC Name: phenyl 1-[1-(3,5-dimethylbenzoyl)-2-(1-phenylethyl)piperidin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[1-(3,5-dimethylbenzoyl)-2-(1-phenylethyl)-4-piperidyl]isonipecotic acid phenyl ester Formula: C34H40N2O3 MolecularWeight: 524.693

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)N2CCC(CC2C(C)C3=CC=CC=C3)N4CCC(CC4)C(=O)OC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)N2CCC(CC2C(C)C3=CC=CC=C3)N4CCC(CC4)C(=O)OC5=CC=CC=C5)C

InChI

InChI=1S/C34H40N2O3/c1-24-20-25(2)22-29(21-24)33(37)36-19-16-30(23-32(36)26(3)27-10-6-4-7-11-27)35-17-14-28(15-18-35)34(38)39-31-12-8-5-9-13-31/h4-13,20-22,26,28,30,32H,14-19,23H2,1-3H3