(2S,3R)-3-(4-cyano-4-phenyl-piperidin-1-yl)carbonyl-5-methyl-2-propyl-hexanamide

Systemtic Name: (2S,3R)-3-(4-cyano-4-phenyl-piperidin-1-yl)carbonyl-5-methyl-2-propyl-hexanamide Openeye Name: (2S,3R)-3-(4-cyano-4-phenyl-piperidine-1-carbonyl)-5-methyl-2-propyl-hexanamide CAS Name: (2S,3R)-3-[(4-cyano-4-phenyl-1-piperidinyl)-oxomethyl]-5-methyl-2-propylhexanamide IUPAC Name: (2S,3R)-3-(4-cyano-4-phenylpiperidine-1-carbonyl)-5-methyl-2-propylhexanamide Traditional Name: (2S,3R)-3-(4-cyano-4-phenyl-piperidine-1-carbonyl)-5-methyl-2-propyl-hexanamide Formula: C23H33N3O2 MolecularWeight: 383.52702

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC(C)C)C(=O)N1CCC(CC1)(C#N)C2=CC=CC=C2)C(=O)N

Isomeric SMILES

CCC[C@@H]([C@@H](CC(C)C)C(=O)N1CCC(CC1)(C#N)C2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C23H33N3O2/c1-4-8-19(21(25)27)20(15-17(2)3)22(28)26-13-11-23(16-24,12-14-26)18-9-6-5-7-10-18/h5-7,9-10,17,19-20H,4,8,11-15H2,1-3H3,(H2,25,27)/t19-,20+/m0/s1