diethyl 7-methoxy-4-phenyl-1-(trifluoromethylsulfonyl)-2H-quinoline-2,3-dicarboxylate

Systemtic Name: diethyl 7-methoxy-4-phenyl-1-(trifluoromethylsulfonyl)-2H-quinoline-2,3-dicarboxylate Openeye Name: diethyl 7-methoxy-4-phenyl-1-(trifluoromethylsulfonyl)-2H-quinoline-2,3-dicarboxylate CAS Name: 7-methoxy-4-phenyl-1-(trifluoromethylsulfonyl)-2H-quinoline-2,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 7-methoxy-4-phenyl-1-(trifluoromethylsulfonyl)-2H-quinoline-2,3-dicarboxylate Traditional Name: 7-methoxy-4-phenyl-1-triflyl-2H-quinoline-2,3-dicarboxylic acid diethyl ester Formula: C23H22F3NO7S MolecularWeight: 513.48349

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(=C(C2=C(N1S(=O)(=O)C(F)(F)F)C=C(C=C2)OC)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1C(=C(C2=C(N1S(=O)(=O)C(F)(F)F)C=C(C=C2)OC)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C23H22F3NO7S/c1-4-33-21(28)19-18(14-9-7-6-8-10-14)16-12-11-15(32-3)13-17(16)27(20(19)22(29)34-5-2)35(30,31)23(24,25)26/h6-13,20H,4-5H2,1-3H3