(3R)-N-(1,3-benzodioxol-5-yl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3R)-N-(1,3-benzodioxol-5-yl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3R)-N-(1,3-benzodioxol-5-yl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: (3R)-N-(1,3-benzodioxol-5-yl)-1-(4-methoxyphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3R)-N-(1,3-benzodioxol-5-yl)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3R)-N-(1,3-benzodioxol-5-yl)-1-(4-methoxyphenyl)sulfonyl-nipecotamide Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H22N2O6S/c1-26-16-5-7-17(8-6-16)29(24,25)22-10-2-3-14(12-22)20(23)21-15-4-9-18-19(11-15)28-13-27-18/h4-9,11,14H,2-3,10,12-13H2,1H3,(H,21,23)/t14-/m1/s1