N-[(1S)-1-(4-ethoxyphenyl)ethyl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[(1S)-1-(4-ethoxyphenyl)ethyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[(1S)-1-(4-ethoxyphenyl)ethyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[(1S)-1-(4-ethoxyphenyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[(1S)-1-(4-ethoxyphenyl)ethyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[(1S)-1-p-phenetylethyl]isonipecotamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@H](C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H28N2O4S/c1-3-28-20-11-9-18(10-12-20)17(2)23-22(25)19-13-15-24(16-14-19)29(26,27)21-7-5-4-6-8-21/h4-12,17,19H,3,13-16H2,1-2H3,(H,23,25)/t17-/m0/s1