1-ethylsulfonyl-N-[4-(2-methylpropanoylamino)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-ethylsulfonyl-N-[4-(2-methylpropanoylamino)phenyl]piperidine-4-carboxamide Openeye Name: 1-ethylsulfonyl-N-[4-(2-methylpropanoylamino)phenyl]piperidine-4-carboxamide CAS Name: 1-ethylsulfonyl-N-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-ethylsulfonyl-N-[4-(2-methylpropanoylamino)phenyl]piperidine-4-carboxamide Traditional Name: 1-esyl-N-[4-(isobutyrylamino)phenyl]isonipecotamide Formula: C18H27N3O4S MolecularWeight: 381.48968

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=C(C=C2)NC(=O)C(C)C

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=C(C=C2)NC(=O)C(C)C

InChI

InChI=1S/C18H27N3O4S/c1-4-26(24,25)21-11-9-14(10-12-21)18(23)20-16-7-5-15(6-8-16)19-17(22)13(2)3/h5-8,13-14H,4,9-12H2,1-3H3,(H,19,22)(H,20,23)