N-[4-(3-methylbutanoylamino)phenyl]-1-(2-phenoxyethanoyl)piperidine-4-carboxamide

Systemtic Name: N-[4-(3-methylbutanoylamino)phenyl]-1-(2-phenoxyethanoyl)piperidine-4-carboxamide Openeye Name: N-[4-(3-methylbutanoylamino)phenyl]-1-(2-phenoxyacetyl)piperidine-4-carboxamide CAS Name: N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-1-(1-oxo-2-phenoxyethyl)-4-piperidinecarboxamide IUPAC Name: N-[4-(3-methylbutanoylamino)phenyl]-1-(2-phenoxyacetyl)piperidine-4-carboxamide Traditional Name: N-[4-(isovalerylamino)phenyl]-1-(2-phenoxyacetyl)isonipecotamide Formula: C25H31N3O4 MolecularWeight: 437.53134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C(=O)COC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C(=O)COC3=CC=CC=C3

InChI

InChI=1S/C25H31N3O4/c1-18(2)16-23(29)26-20-8-10-21(11-9-20)27-25(31)19-12-14-28(15-13-19)24(30)17-32-22-6-4-3-5-7-22/h3-11,18-19H,12-17H2,1-2H3,(H,26,29)(H,27,31)