N-butyl-1-[3-(2-methylpropanoylamino)phenyl]carbonyl-piperidine-4-carboxamide

Systemtic Name: N-butyl-1-[3-(2-methylpropanoylamino)phenyl]carbonyl-piperidine-4-carboxamide Openeye Name: N-butyl-1-[3-(2-methylpropanoylamino)benzoyl]piperidine-4-carboxamide CAS Name: N-butyl-1-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-butyl-1-[3-(2-methylpropanoylamino)benzoyl]piperidine-4-carboxamide Traditional Name: N-butyl-1-[3-(isobutyrylamino)benzoyl]isonipecotamide Formula: C21H31N3O3 MolecularWeight: 373.48914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1CCN(CC1)C(=O)C2=CC(=CC=C2)NC(=O)C(C)C

Isomeric SMILES

CCCCNC(=O)C1CCN(CC1)C(=O)C2=CC(=CC=C2)NC(=O)C(C)C

InChI

InChI=1S/C21H31N3O3/c1-4-5-11-22-20(26)16-9-12-24(13-10-16)21(27)17-7-6-8-18(14-17)23-19(25)15(2)3/h6-8,14-16H,4-5,9-13H2,1-3H3,(H,22,26)(H,23,25)