(2R,3S)-N-(3-tert-butylphenyl)-1-(2-cyclopropyl-6-methyl-phenyl)carbonyl-2-phenyl-piperidine-3-carboxamide

Systemtic Name: (2R,3S)-N-(3-tert-butylphenyl)-1-(2-cyclopropyl-6-methyl-phenyl)carbonyl-2-phenyl-piperidine-3-carboxamide Openeye Name: (2R,3S)-N-(3-tert-butylphenyl)-1-(2-cyclopropyl-6-methyl-benzoyl)-2-phenyl-piperidine-3-carboxamide CAS Name: (2R,3S)-N-(3-tert-butylphenyl)-1-[(2-cyclopropyl-6-methylphenyl)-oxomethyl]-2-phenyl-3-piperidinecarboxamide IUPAC Name: (2R,3S)-N-(3-tert-butylphenyl)-1-(2-cyclopropyl-6-methylbenzoyl)-2-phenylpiperidine-3-carboxamide Traditional Name: (2R,3S)-N-(3-tert-butylphenyl)-1-(2-cyclopropyl-6-methyl-benzoyl)-2-phenyl-nipecotamide Formula: C33H38N2O2 MolecularWeight: 494.66702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1C(=O)N2CCCC(C2C3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C(C)(C)C)C5CC5

Isomeric SMILES

CC1=CC=CC(=C1C(=O)N2CCC[C@@H]([C@@H]2C3=CC=CC=C3)C(=O)NC4=CC=CC(=C4)C(C)(C)C)C5CC5

InChI

InChI=1S/C33H38N2O2/c1-22-11-8-16-27(23-18-19-23)29(22)32(37)35-20-10-17-28(30(35)24-12-6-5-7-13-24)31(36)34-26-15-9-14-25(21-26)33(2,3)4/h5-9,11-16,21,23,28,30H,10,17-20H2,1-4H3,(H,34,36)/t28-,30-/m0/s1