(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl) 4-bromanyl-3-methyl-benzenesulfonate

Systemtic Name: (2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl) 4-bromanyl-3-methyl-benzenesulfonate Openeye Name: (2-oxo-3,4-dihydro-1H-quinolin-6-yl) 4-bromo-3-methyl-benzenesulfonate CAS Name: 4-bromo-3-methylbenzenesulfonic acid (2-oxo-3,4-dihydro-1H-quinolin-6-yl) ester IUPAC Name: (2-oxo-3,4-dihydro-1H-quinolin-6-yl) 4-bromo-3-methylbenzenesulfonate Traditional Name: 4-bromo-3-methyl-benzenesulfonic acid (2-keto-3,4-dihydro-1H-quinolin-6-yl) ester Formula: C16H14BrNO4S MolecularWeight: 396.25566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)OC2=CC3=C(C=C2)NC(=O)CC3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)OC2=CC3=C(C=C2)NC(=O)CC3)Br

InChI

InChI=1S/C16H14BrNO4S/c1-10-8-13(4-5-14(10)17)23(20,21)22-12-3-6-15-11(9-12)2-7-16(19)18-15/h3-6,8-9H,2,7H2,1H3,(H,18,19)