N-[4-[2-(ethylamino)-2-oxidanylidene-ethoxy]phenyl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[4-[2-(ethylamino)-2-oxidanylidene-ethoxy]phenyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[4-[2-(ethylamino)-2-oxo-ethoxy]phenyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[4-[2-(ethylamino)-2-keto-ethoxy]phenyl]isonipecotamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)COC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCNC(=O)COC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H27N3O5S/c1-2-23-21(26)16-30-19-10-8-18(9-11-19)24-22(27)17-12-14-25(15-13-17)31(28,29)20-6-4-3-5-7-20/h3-11,17H,2,12-16H2,1H3,(H,23,26)(H,24,27)