(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl) 2,5-bis(chloranyl)-3,6-dimethyl-benzenesulfonate

Systemtic Name: (2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl) 2,5-bis(chloranyl)-3,6-dimethyl-benzenesulfonate Openeye Name: (2-oxo-3,4-dihydro-1H-quinolin-6-yl) 2,5-dichloro-3,6-dimethyl-benzenesulfonate CAS Name: 2,5-dichloro-3,6-dimethylbenzenesulfonic acid (2-oxo-3,4-dihydro-1H-quinolin-6-yl) ester IUPAC Name: (2-oxo-3,4-dihydro-1H-quinolin-6-yl) 2,5-dichloro-3,6-dimethylbenzenesulfonate Traditional Name: 2,5-dichloro-3,6-dimethyl-benzenesulfonic acid (2-keto-3,4-dihydro-1H-quinolin-6-yl) ester Formula: C17H15Cl2NO4S MolecularWeight: 400.2763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Cl)S(=O)(=O)OC2=CC3=C(C=C2)NC(=O)CC3)C)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1Cl)S(=O)(=O)OC2=CC3=C(C=C2)NC(=O)CC3)C)Cl

InChI

InChI=1S/C17H15Cl2NO4S/c1-9-7-13(18)10(2)17(16(9)19)25(22,23)24-12-4-5-14-11(8-12)3-6-15(21)20-14/h4-5,7-8H,3,6H2,1-2H3,(H,20,21)