(3R)-N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3R)-N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3R)-N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3R)-N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3R)-N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3R)-N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C19H19ClN2O5S MolecularWeight: 422.88256

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3COC4=CC=CC=C4O3)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)[C@H]3COC4=CC=CC=C4O3)Cl

InChI

InChI=1S/C19H19ClN2O5S/c20-14-8-7-13(11-18(14)28(24,25)22-9-3-4-10-22)21-19(23)17-12-26-15-5-1-2-6-16(15)27-17/h1-2,5-8,11,17H,3-4,9-10,12H2,(H,21,23)/t17-/m1/s1