(3S,5R)-N-[[4-chloranyl-3-(3-methoxypropoxy)phenyl]methyl]-N-cyclopropyl-5-(2,2-dimethylpropanoylamino)piperidine-3-carboxamide

Systemtic Name: (3S,5R)-N-[[4-chloranyl-3-(3-methoxypropoxy)phenyl]methyl]-N-cyclopropyl-5-(2,2-dimethylpropanoylamino)piperidine-3-carboxamide Openeye Name: (3S,5R)-N-[[4-chloro-3-(3-methoxypropoxy)phenyl]methyl]-N-cyclopropyl-5-(2,2-dimethylpropanoylamino)piperidine-3-carboxamide CAS Name: (3S,5R)-N-[[4-chloro-3-(3-methoxypropoxy)phenyl]methyl]-N-cyclopropyl-5-[(2,2-dimethyl-1-oxopropyl)amino]-3-piperidinecarboxamide IUPAC Name: (3S,5R)-N-[[4-chloro-3-(3-methoxypropoxy)phenyl]methyl]-N-cyclopropyl-5-(2,2-dimethylpropanoylamino)piperidine-3-carboxamide Traditional Name: (3S,5R)-N-[4-chloro-3-(3-methoxypropoxy)benzyl]-N-cyclopropyl-5-(pivaloylamino)nipecotamide Formula: C25H38ClN3O4 MolecularWeight: 480.03992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1CC(CNC1)C(=O)N(CC2=CC(=C(C=C2)Cl)OCCCOC)C3CC3

Isomeric SMILES

CC(C)(C)C(=O)N[C@@H]1C[C@@H](CNC1)C(=O)N(CC2=CC(=C(C=C2)Cl)OCCCOC)C3CC3

InChI

InChI=1S/C25H38ClN3O4/c1-25(2,3)24(31)28-19-13-18(14-27-15-19)23(30)29(20-7-8-20)16-17-6-9-21(26)22(12-17)33-11-5-10-32-4/h6,9,12,18-20,27H,5,7-8,10-11,13-16H2,1-4H3,(H,28,31)/t18-,19+/m0/s1