1-butyl-2-(2-methoxyphenyl)-6-oxidanylidene-N-[3-(propanoylamino)phenyl]piperidine-3-carboxamide

Systemtic Name: 1-butyl-2-(2-methoxyphenyl)-6-oxidanylidene-N-[3-(propanoylamino)phenyl]piperidine-3-carboxamide Openeye Name: 1-butyl-2-(2-methoxyphenyl)-6-oxo-N-[3-(propanoylamino)phenyl]piperidine-3-carboxamide CAS Name: 1-butyl-2-(2-methoxyphenyl)-6-oxo-N-[3-(1-oxopropylamino)phenyl]-3-piperidinecarboxamide IUPAC Name: 1-butyl-2-(2-methoxyphenyl)-6-oxo-N-[3-(propanoylamino)phenyl]piperidine-3-carboxamide Traditional Name: 1-butyl-6-keto-2-(2-methoxyphenyl)-N-(3-propionamidophenyl)nipecotamide Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(CCC1=O)C(=O)NC2=CC(=CC=C2)NC(=O)CC)C3=CC=CC=C3OC

Isomeric SMILES

CCCCN1C(C(CCC1=O)C(=O)NC2=CC(=CC=C2)NC(=O)CC)C3=CC=CC=C3OC

InChI

InChI=1S/C26H33N3O4/c1-4-6-16-29-24(31)15-14-21(25(29)20-12-7-8-13-22(20)33-3)26(32)28-19-11-9-10-18(17-19)27-23(30)5-2/h7-13,17,21,25H,4-6,14-16H2,1-3H3,(H,27,30)(H,28,32)