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

Systemtic Name: 1-cyclopropylcarbonyl-N-[4-(3-methylbutanoylamino)phenyl]piperidine-4-carboxamide Openeye Name: 1-(cyclopropanecarbonyl)-N-[4-(3-methylbutanoylamino)phenyl]piperidine-4-carboxamide CAS Name: 1-[cyclopropyl(oxo)methyl]-N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(cyclopropanecarbonyl)-N-[4-(3-methylbutanoylamino)phenyl]piperidine-4-carboxamide Traditional Name: 1-(cyclopropanecarbonyl)-N-[4-(isovalerylamino)phenyl]isonipecotamide Formula: C21H29N3O3 MolecularWeight: 371.47326

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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)C3CC3

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C(=O)C3CC3

InChI

InChI=1S/C21H29N3O3/c1-14(2)13-19(25)22-17-5-7-18(8-6-17)23-20(26)15-9-11-24(12-10-15)21(27)16-3-4-16/h5-8,14-16H,3-4,9-13H2,1-2H3,(H,22,25)(H,23,26)