(3R)-N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3R)-N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3R)-N-[2-ethoxy-5-(1-piperidylsulfonyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3R)-N-[2-ethoxy-5-(1-piperidinylsulfonyl)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3R)-N-(2-ethoxy-5-piperidin-1-ylsulfonylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3R)-N-(2-ethoxy-5-piperidinosulfonyl-phenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C22H26N2O6S MolecularWeight: 446.51664

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)[C@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C22H26N2O6S/c1-2-28-18-11-10-16(31(26,27)24-12-6-3-7-13-24)14-17(18)23-22(25)21-15-29-19-8-4-5-9-20(19)30-21/h4-5,8-11,14,21H,2-3,6-7,12-13,15H2,1H3,(H,23,25)/t21-/m1/s1