(3S)-N-(4-ethoxyphenyl)-1-(4-methoxy-3-methyl-phenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(4-ethoxyphenyl)-1-(4-methoxy-3-methyl-phenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(4-ethoxyphenyl)-1-(4-methoxy-3-methyl-phenyl)sulfonyl-piperidine-3-carboxamide CAS Name: (3S)-N-(4-ethoxyphenyl)-1-(4-methoxy-3-methylphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-(4-ethoxyphenyl)-1-(4-methoxy-3-methylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3S)-1-(4-methoxy-3-methyl-phenyl)sulfonyl-N-p-phenetyl-nipecotamide Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC(=C(C=C3)OC)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC(=C(C=C3)OC)C

InChI

InChI=1S/C22H28N2O5S/c1-4-29-19-9-7-18(8-10-19)23-22(25)17-6-5-13-24(15-17)30(26,27)20-11-12-21(28-3)16(2)14-20/h7-12,14,17H,4-6,13,15H2,1-3H3,(H,23,25)/t17-/m0/s1