(3S)-1-[(2S)-2-(cyclohexylcarbonylamino)-3-methyl-butanoyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-[(2S)-2-(cyclohexylcarbonylamino)-3-methyl-butanoyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: (3S)-1-[(2S)-2-(cyclohexanecarbonylamino)-3-methyl-butanoyl]-N-phenyl-piperidine-3-carboxamide CAS Name: (3S)-1-[(2S)-2-[[cyclohexyl(oxo)methyl]amino]-3-methyl-1-oxobutyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-[(2S)-2-(cyclohexanecarbonylamino)-3-methylbutanoyl]-N-phenylpiperidine-3-carboxamide Traditional Name: (3S)-1-[(2S)-2-(cyclohexanecarbonylamino)-3-methyl-butanoyl]-N-phenyl-nipecotamide Formula: C24H35N3O3 MolecularWeight: 413.553

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCCC(C1)C(=O)NC2=CC=CC=C2)NC(=O)C3CCCCC3

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCC[C@@H](C1)C(=O)NC2=CC=CC=C2)NC(=O)C3CCCCC3

InChI

InChI=1S/C24H35N3O3/c1-17(2)21(26-22(28)18-10-5-3-6-11-18)24(30)27-15-9-12-19(16-27)23(29)25-20-13-7-4-8-14-20/h4,7-8,13-14,17-19,21H,3,5-6,9-12,15-16H2,1-2H3,(H,25,29)(H,26,28)/t19-,21-/m0/s1