1-(4-butylphenyl)carbonyl-N-[(2R)-2-[(2-methylphenyl)carbonylamino]cyclohexyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-butylphenyl)carbonyl-N-[(2R)-2-[(2-methylphenyl)carbonylamino]cyclohexyl]piperidine-4-carboxamide Openeye Name: 1-(4-butylbenzoyl)-N-[(2R)-2-[(2-methylbenzoyl)amino]cyclohexyl]piperidine-4-carboxamide CAS Name: 1-[(4-butylphenyl)-oxomethyl]-N-[(2R)-2-[[(2-methylphenyl)-oxomethyl]amino]cyclohexyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-butylbenzoyl)-N-[(2R)-2-[(2-methylbenzoyl)amino]cyclohexyl]piperidine-4-carboxamide Traditional Name: 1-(4-butylbenzoyl)-N-[(2R)-2-(o-toluoylamino)cyclohexyl]isonipecotamide Formula: C31H41N3O3 MolecularWeight: 503.67554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)NC3CCCCC3NC(=O)C4=CC=CC=C4C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)NC3CCCC[C@H]3NC(=O)C4=CC=CC=C4C

InChI

InChI=1S/C31H41N3O3/c1-3-4-10-23-14-16-25(17-15-23)31(37)34-20-18-24(19-21-34)29(35)32-27-12-7-8-13-28(27)33-30(36)26-11-6-5-9-22(26)2/h5-6,9,11,14-17,24,27-28H,3-4,7-8,10,12-13,18-21H2,1-2H3,(H,32,35)(H,33,36)/t27?,28-/m1/s1