(3,3-dimethyl-2-oxidanylidene-butyl) 2-[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)carbonylamino]benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)carbonylamino]benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-[(1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]benzoate CAS Name: 2-[[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-oxomethyl]amino]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-[(1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]benzoate Traditional Name: 2-[(1-mesyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C24H28N2O6S MolecularWeight: 472.55392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

InChI

InChI=1S/C24H28N2O6S/c1-24(2,3)21(27)15-32-23(29)18-9-5-6-10-19(18)25-22(28)17-11-12-20-16(14-17)8-7-13-26(20)33(4,30)31/h5-6,9-12,14H,7-8,13,15H2,1-4H3,(H,25,28)