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

Systemtic Name: methyl 4-methyl-3-[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)carbonylamino]benzoate Openeye Name: methyl 4-methyl-3-[(1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]benzoate CAS Name: 4-methyl-3-[[(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[(1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]benzoate Traditional Name: 3-[(1-mesyl-3,4-dihydro-2H-quinoline-6-carbonyl)amino]-4-methyl-benzoic acid methyl ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

InChI

InChI=1S/C20H22N2O5S/c1-13-6-7-16(20(24)27-2)12-17(13)21-19(23)15-8-9-18-14(11-15)5-4-10-22(18)28(3,25)26/h6-9,11-12H,4-5,10H2,1-3H3,(H,21,23)