N-[(1S)-1-(2-bromophenyl)ethyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: N-[(1S)-1-(2-bromophenyl)ethyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-[(1S)-1-(2-bromophenyl)ethyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-[(1S)-1-(2-bromophenyl)ethyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-[(1S)-1-(2-bromophenyl)ethyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: N-[(1S)-1-(2-bromophenyl)ethyl]-1-mesyl-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C19H21BrN2O3S MolecularWeight: 437.35064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Br)NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

Isomeric SMILES

C[C@@H](C1=CC=CC=C1Br)NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

InChI

InChI=1S/C19H21BrN2O3S/c1-13(16-7-3-4-8-17(16)20)21-19(23)15-9-10-18-14(12-15)6-5-11-22(18)26(2,24)25/h3-4,7-10,12-13H,5-6,11H2,1-2H3,(H,21,23)/t13-/m0/s1