N-[(2R)-2-benzamidocyclohexyl]-1-(4-butylphenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[(2R)-2-benzamidocyclohexyl]-1-(4-butylphenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[(2R)-2-benzamidocyclohexyl]-1-(4-butylbenzoyl)piperidine-4-carboxamide CAS Name: N-[(2R)-2-benzamidocyclohexyl]-1-[(4-butylphenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-[(2R)-2-benzamidocyclohexyl]-1-(4-butylbenzoyl)piperidine-4-carboxamide Traditional Name: N-[(2R)-2-benzamidocyclohexyl]-1-(4-butylbenzoyl)isonipecotamide Formula: C30H39N3O3 MolecularWeight: 489.64896

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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=C4

Isomeric SMILES

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

InChI

InChI=1S/C30H39N3O3/c1-2-3-9-22-14-16-25(17-15-22)30(36)33-20-18-24(19-21-33)29(35)32-27-13-8-7-12-26(27)31-28(34)23-10-5-4-6-11-23/h4-6,10-11,14-17,24,26-27H,2-3,7-9,12-13,18-21H2,1H3,(H,31,34)(H,32,35)/t26-,27?/m1/s1