3-bromanyl-N-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]benzenesulfonamide

Systemtic Name: 3-bromanyl-N-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]benzenesulfonamide Openeye Name: 3-bromo-N-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]benzenesulfonamide CAS Name: 3-bromo-N-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]benzenesulfonamide IUPAC Name: 3-bromo-N-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]benzenesulfonamide Traditional Name: 3-bromo-N-[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]benzenesulfonamide Formula: C17H18BrNO4S MolecularWeight: 412.29812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)NS(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)NS(=O)(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H18BrNO4S/c1-3-22-17-8-12-7-11(2)23-16(12)10-15(17)19-24(20,21)14-6-4-5-13(18)9-14/h4-6,8-11,19H,3,7H2,1-2H3/t11-/m0/s1