N-[4-[2-(methylamino)-2-oxidanylidene-ethyl]phenyl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-[2-(methylamino)-2-oxidanylidene-ethyl]phenyl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-[2-(methylamino)-2-oxo-ethyl]phenyl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[4-[2-(methylamino)-2-oxoethyl]phenyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-[2-(methylamino)-2-oxoethyl]phenyl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-[4-[2-keto-2-(methylamino)ethyl]phenyl]-1-mesyl-isonipecotamide Formula: C16H23N3O4S MolecularWeight: 353.43652

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CNC(=O)CC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C

InChI

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