N-[(3S)-6-bromanyl-1-(phenylmethyl)-3,4-dihydro-2H-quinolin-3-yl]benzenesulfonamide

Systemtic Name: N-[(3S)-6-bromanyl-1-(phenylmethyl)-3,4-dihydro-2H-quinolin-3-yl]benzenesulfonamide Openeye Name: N-[(3S)-1-benzyl-6-bromo-3,4-dihydro-2H-quinolin-3-yl]benzenesulfonamide CAS Name: N-[(3S)-6-bromo-1-(phenylmethyl)-3,4-dihydro-2H-quinolin-3-yl]benzenesulfonamide IUPAC Name: N-[(3S)-1-benzyl-6-bromo-3,4-dihydro-2H-quinolin-3-yl]benzenesulfonamide Traditional Name: N-[(3S)-1-benzyl-6-bromo-3,4-dihydro-2H-quinolin-3-yl]benzenesulfonamide Formula: C22H21BrN2O2S MolecularWeight: 457.38334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C2=C1C=C(C=C2)Br)CC3=CC=CC=C3)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1[C@@H](CN(C2=C1C=C(C=C2)Br)CC3=CC=CC=C3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H21BrN2O2S/c23-19-11-12-22-18(13-19)14-20(16-25(22)15-17-7-3-1-4-8-17)24-28(26,27)21-9-5-2-6-10-21/h1-13,20,24H,14-16H2/t20-/m0/s1