N-(1-azanyl-1-oxidanylidene-butan-2-yl)-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(1-azanyl-1-oxidanylidene-butan-2-yl)-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(1-carbamoylpropyl)piperidine-4-carboxamide CAS Name: N-(1-amino-1-oxobutan-2-yl)-1-(benzenesulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(1-amino-1-oxobutan-2-yl)-1-(benzenesulfonyl)piperidine-4-carboxamide Traditional Name: 1-besyl-N-(1-carbamoylpropyl)isonipecotamide Formula: C16H23N3O4S MolecularWeight: 353.43652

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCC(C(=O)N)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H23N3O4S/c1-2-14(15(17)20)18-16(21)12-8-10-19(11-9-12)24(22,23)13-6-4-3-5-7-13/h3-7,12,14H,2,8-11H2,1H3,(H2,17,20)(H,18,21)