1-(4-butylphenyl)carbonyl-N-[(2R)-2-[(2-methylphenyl)carbonylamino]cyclohexyl]piperidine-3-carboxamide

Systemtic Name: 1-(4-butylphenyl)carbonyl-N-[(2R)-2-[(2-methylphenyl)carbonylamino]cyclohexyl]piperidine-3-carboxamide Openeye Name: 1-(4-butylbenzoyl)-N-[(2R)-2-[(2-methylbenzoyl)amino]cyclohexyl]piperidine-3-carboxamide CAS Name: 1-[(4-butylphenyl)-oxomethyl]-N-[(2R)-2-[[(2-methylphenyl)-oxomethyl]amino]cyclohexyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-butylbenzoyl)-N-[(2R)-2-[(2-methylbenzoyl)amino]cyclohexyl]piperidine-3-carboxamide Traditional Name: 1-(4-butylbenzoyl)-N-[(2R)-2-(o-toluoylamino)cyclohexyl]nipecotamide Formula: C31H41N3O3 MolecularWeight: 503.67554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NC3CCCCC3NC(=O)C4=CC=CC=C4C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NC3CCCC[C@H]3NC(=O)C4=CC=CC=C4C

InChI

InChI=1S/C31H41N3O3/c1-3-4-11-23-16-18-24(19-17-23)31(37)34-20-9-12-25(21-34)29(35)32-27-14-7-8-15-28(27)33-30(36)26-13-6-5-10-22(26)2/h5-6,10,13,16-19,25,27-28H,3-4,7-9,11-12,14-15,20-21H2,1-2H3,(H,32,35)(H,33,36)/t25?,27?,28-/m1/s1