(2-oxidanylidene-1-phenyl-5,6,7,8-tetrahydroquinolin-4-yl) 2,3-bis(chloranyl)-4-methylsulfonyl-benzoate

Systemtic Name: (2-oxidanylidene-1-phenyl-5,6,7,8-tetrahydroquinolin-4-yl) 2,3-bis(chloranyl)-4-methylsulfonyl-benzoate Openeye Name: (2-oxo-1-phenyl-5,6,7,8-tetrahydroquinolin-4-yl) 2,3-dichloro-4-methylsulfonyl-benzoate CAS Name: 2,3-dichloro-4-methylsulfonylbenzoic acid (2-oxo-1-phenyl-5,6,7,8-tetrahydroquinolin-4-yl) ester IUPAC Name: (2-oxo-1-phenyl-5,6,7,8-tetrahydroquinolin-4-yl) 2,3-dichloro-4-methylsulfonylbenzoate Traditional Name: 2,3-dichloro-4-mesyl-benzoic acid (2-keto-1-phenyl-5,6,7,8-tetrahydroquinolin-4-yl) ester Formula: C23H19Cl2NO5S MolecularWeight: 492.37166

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)OC2=CC(=O)N(C3=C2CCCC3)C4=CC=CC=C4)Cl)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C(=C(C=C1)C(=O)OC2=CC(=O)N(C3=C2CCCC3)C4=CC=CC=C4)Cl)Cl

InChI

InChI=1S/C23H19Cl2NO5S/c1-32(29,30)19-12-11-16(21(24)22(19)25)23(28)31-18-13-20(27)26(14-7-3-2-4-8-14)17-10-6-5-9-15(17)18/h2-4,7-8,11-13H,5-6,9-10H2,1H3