(7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-[[3-(trifluoromethyl)phenyl]amino]pyridine-3-carboxylate

Systemtic Name: (7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-[[3-(trifluoromethyl)phenyl]amino]pyridine-3-carboxylate Openeye Name: (7-methyl-2-oxo-chromen-4-yl)methyl 2-[3-(trifluoromethyl)anilino]pyridine-3-carboxylate CAS Name: 2-[3-(trifluoromethyl)anilino]-3-pyridinecarboxylic acid (7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxochromen-4-yl)methyl 2-[3-(trifluoromethyl)anilino]pyridine-3-carboxylate Traditional Name: 2-[3-(trifluoromethyl)anilino]nicotinic acid (2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C24H17F3N2O4 MolecularWeight: 454.39799

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=C(N=CC=C3)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=C(N=CC=C3)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C24H17F3N2O4/c1-14-7-8-18-15(11-21(30)33-20(18)10-14)13-32-23(31)19-6-3-9-28-22(19)29-17-5-2-4-16(12-17)24(25,26)27/h2-12H,13H2,1H3,(H,28,29)