6,7-dimethoxy-2-methyl-4-[(phenylmethyl)-(trifluoromethylsulfonyl)amino]-3,4-dihydro-2H-quinoline-1-carboxylic acid

Systemtic Name: 6,7-dimethoxy-2-methyl-4-[(phenylmethyl)-(trifluoromethylsulfonyl)amino]-3,4-dihydro-2H-quinoline-1-carboxylic acid Openeye Name: 4-[benzyl(trifluoromethylsulfonyl)amino]-6,7-dimethoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid CAS Name: 6,7-dimethoxy-2-methyl-4-[(phenylmethyl)-(trifluoromethylsulfonyl)amino]-3,4-dihydro-2H-quinoline-1-carboxylic acid IUPAC Name: 4-[benzyl(trifluoromethylsulfonyl)amino]-6,7-dimethoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid Traditional Name: 4-[benzyl(triflyl)amino]-6,7-dimethoxy-2-methyl-3,4-dihydro-2H-quinoline-1-carboxylic acid Formula: C21H23F3N2O6S MolecularWeight: 488.47733

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C2=CC(=C(C=C2N1C(=O)O)OC)OC)N(CC3=CC=CC=C3)S(=O)(=O)C(F)(F)F

Isomeric SMILES

CC1CC(C2=CC(=C(C=C2N1C(=O)O)OC)OC)N(CC3=CC=CC=C3)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C21H23F3N2O6S/c1-13-9-16(15-10-18(31-2)19(32-3)11-17(15)26(13)20(27)28)25(33(29,30)21(22,23)24)12-14-7-5-4-6-8-14/h4-8,10-11,13,16H,9,12H2,1-3H3,(H,27,28)