methyl 4-[[3-methyl-2-oxidanylidene-4-[3-(trifluoromethyl)phenyl]carbonyl-3H-quinoxalin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[3-methyl-2-oxidanylidene-4-[3-(trifluoromethyl)phenyl]carbonyl-3H-quinoxalin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[3-methyl-2-oxo-4-[3-(trifluoromethyl)benzoyl]-3H-quinoxalin-1-yl]methyl]benzoate CAS Name: 4-[[3-methyl-2-oxo-4-[oxo-[3-(trifluoromethyl)phenyl]methyl]-3H-quinoxalin-1-yl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-methyl-2-oxo-4-[3-(trifluoromethyl)benzoyl]-3H-quinoxalin-1-yl]methyl]benzoate Traditional Name: 4-[[2-keto-3-methyl-4-[3-(trifluoromethyl)benzoyl]-3H-quinoxalin-1-yl]methyl]benzoic acid methyl ester Formula: C26H21F3N2O4 MolecularWeight: 482.45115

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2N1C(=O)C3=CC(=CC=C3)C(F)(F)F)CC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1C(=O)N(C2=CC=CC=C2N1C(=O)C3=CC(=CC=C3)C(F)(F)F)CC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C26H21F3N2O4/c1-16-23(32)30(15-17-10-12-18(13-11-17)25(34)35-2)21-8-3-4-9-22(21)31(16)24(33)19-6-5-7-20(14-19)26(27,28)29/h3-14,16H,15H2,1-2H3