ethyl (3S)-1-[1-[(4-phenylphenyl)methyl]piperidin-4-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[1-[(4-phenylphenyl)methyl]piperidin-4-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[1-[(4-phenylphenyl)methyl]piperidine-4-carbonyl]piperidine-3-carboxylate CAS Name: (3S)-1-[oxo-[1-[(4-phenylphenyl)methyl]-4-piperidinyl]methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[1-[(4-phenylphenyl)methyl]piperidine-4-carbonyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[1-(4-phenylbenzyl)isonipecotoyl]nipecotic acid ethyl ester Formula: C27H34N2O3 MolecularWeight: 434.57046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2CCN(CC2)CC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C(=O)C2CCN(CC2)CC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H34N2O3/c1-2-32-27(31)25-9-6-16-29(20-25)26(30)24-14-17-28(18-15-24)19-21-10-12-23(13-11-21)22-7-4-3-5-8-22/h3-5,7-8,10-13,24-25H,2,6,9,14-20H2,1H3/t25-/m0/s1