3-bromanyl-N-[(3R)-3-(dimethylamino)-5-methoxy-3,4-dihydro-2H-chromen-8-yl]benzenesulfonamide

Systemtic Name: 3-bromanyl-N-[(3R)-3-(dimethylamino)-5-methoxy-3,4-dihydro-2H-chromen-8-yl]benzenesulfonamide Openeye Name: 3-bromo-N-[(3R)-3-(dimethylamino)-5-methoxy-chroman-8-yl]benzenesulfonamide CAS Name: 3-bromo-N-[(3R)-3-(dimethylamino)-5-methoxy-3,4-dihydro-2H-1-benzopyran-8-yl]benzenesulfonamide IUPAC Name: 3-bromo-N-[(3R)-3-(dimethylamino)-5-methoxy-3,4-dihydro-2H-chromen-8-yl]benzenesulfonamide Traditional Name: 3-bromo-N-[(3R)-3-(dimethylamino)-5-methoxy-chroman-8-yl]benzenesulfonamide Formula: C18H21BrN2O4S MolecularWeight: 441.33934

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CC2=C(C=CC(=C2OC1)NS(=O)(=O)C3=CC(=CC=C3)Br)OC

Isomeric SMILES

CN(C)[C@@H]1CC2=C(C=CC(=C2OC1)NS(=O)(=O)C3=CC(=CC=C3)Br)OC

InChI

InChI=1S/C18H21BrN2O4S/c1-21(2)13-10-15-17(24-3)8-7-16(18(15)25-11-13)20-26(22,23)14-6-4-5-12(19)9-14/h4-9,13,20H,10-11H2,1-3H3/t13-/m1/s1