(3S)-N-(2,5-diethoxyphenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(2,5-diethoxyphenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(2,5-diethoxyphenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: (3S)-N-(2,5-diethoxyphenyl)-1-(4-methoxyphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-(2,5-diethoxyphenyl)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-(2,5-diethoxyphenyl)-1-(4-methoxyphenyl)sulfonyl-nipecotamide Formula: C23H30N2O6S MolecularWeight: 462.5591

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N2O6S/c1-4-30-19-10-13-22(31-5-2)21(15-19)24-23(26)17-7-6-14-25(16-17)32(27,28)20-11-8-18(29-3)9-12-20/h8-13,15,17H,4-7,14,16H2,1-3H3,(H,24,26)/t17-/m0/s1