ethyl 1-[(1R,2R)-2-phenylcyclopropyl]carbonyl-4-(3-phenylpropyl)piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(1R,2R)-2-phenylcyclopropyl]carbonyl-4-(3-phenylpropyl)piperidine-4-carboxylate Openeye Name: ethyl 1-[(1R,2R)-2-phenylcyclopropanecarbonyl]-4-(3-phenylpropyl)piperidine-4-carboxylate CAS Name: 1-[oxo-[(1R,2R)-2-phenylcyclopropyl]methyl]-4-(3-phenylpropyl)-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(1R,2R)-2-phenylcyclopropanecarbonyl]-4-(3-phenylpropyl)piperidine-4-carboxylate Traditional Name: 1-[(1R,2R)-2-phenylcyclopropanecarbonyl]-4-(3-phenylpropyl)isonipecotic acid ethyl ester Formula: C27H33NO3 MolecularWeight: 419.55582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)C2CC2C3=CC=CC=C3)CCCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)[C@@H]2C[C@H]2C3=CC=CC=C3)CCCC4=CC=CC=C4

InChI

InChI=1S/C27H33NO3/c1-2-31-26(30)27(15-9-12-21-10-5-3-6-11-21)16-18-28(19-17-27)25(29)24-20-23(24)22-13-7-4-8-14-22/h3-8,10-11,13-14,23-24H,2,9,12,15-20H2,1H3/t23-,24+/m0/s1