(2R,3S)-1-butyl-N-[3-(cyclopropylcarbamoyl)phenyl]-2-(2-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxamide

Systemtic Name: (2R,3S)-1-butyl-N-[3-(cyclopropylcarbamoyl)phenyl]-2-(2-methoxyphenyl)-6-oxidanylidene-piperidine-3-carboxamide Openeye Name: (2R,3S)-1-butyl-N-[3-(cyclopropylcarbamoyl)phenyl]-2-(2-methoxyphenyl)-6-oxo-piperidine-3-carboxamide CAS Name: (2R,3S)-1-butyl-N-[3-[(cyclopropylamino)-oxomethyl]phenyl]-2-(2-methoxyphenyl)-6-oxo-3-piperidinecarboxamide IUPAC Name: (2R,3S)-1-butyl-N-[3-(cyclopropylcarbamoyl)phenyl]-2-(2-methoxyphenyl)-6-oxopiperidine-3-carboxamide Traditional Name: (2R,3S)-1-butyl-N-[3-(cyclopropylcarbamoyl)phenyl]-6-keto-2-(2-methoxyphenyl)nipecotamide Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(CCC1=O)C(=O)NC2=CC=CC(=C2)C(=O)NC3CC3)C4=CC=CC=C4OC

Isomeric SMILES

CCCCN1[C@H]([C@H](CCC1=O)C(=O)NC2=CC=CC(=C2)C(=O)NC3CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C27H33N3O4/c1-3-4-16-30-24(31)15-14-22(25(30)21-10-5-6-11-23(21)34-2)27(33)29-20-9-7-8-18(17-20)26(32)28-19-12-13-19/h5-11,17,19,22,25H,3-4,12-16H2,1-2H3,(H,28,32)(H,29,33)/t22-,25-/m0/s1