(3S)-1-(4-methoxyphenyl)sulfonyl-N-[(2S)-2-phenylpropyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-methoxyphenyl)sulfonyl-N-[(2S)-2-phenylpropyl]piperidine-3-carboxamide Openeye Name: (3S)-1-(4-methoxyphenyl)sulfonyl-N-[(2S)-2-phenylpropyl]piperidine-3-carboxamide CAS Name: (3S)-1-(4-methoxyphenyl)sulfonyl-N-[(2S)-2-phenylpropyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-methoxyphenyl)sulfonyl-N-[(2S)-2-phenylpropyl]piperidine-3-carboxamide Traditional Name: (3S)-1-(4-methoxyphenyl)sulfonyl-N-[(2S)-2-phenylpropyl]nipecotamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)OC)C3=CC=CC=C3

Isomeric SMILES

C[C@H](CNC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C22H28N2O4S/c1-17(18-7-4-3-5-8-18)15-23-22(25)19-9-6-14-24(16-19)29(26,27)21-12-10-20(28-2)11-13-21/h3-5,7-8,10-13,17,19H,6,9,14-16H2,1-2H3,(H,23,25)/t17-,19+/m1/s1