ethyl 1-[3-[(2-oxidanylidenechromen-3-yl)carbonylamino]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[3-[(2-oxidanylidenechromen-3-yl)carbonylamino]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate Openeye Name: ethyl 1-[3-[(2-oxochromene-3-carbonyl)amino]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate CAS Name: 1-[3-[[oxo-(2-oxo-1-benzopyran-3-yl)methyl]amino]phenyl]-5-(trifluoromethyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(2-oxochromene-3-carbonyl)amino]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate Traditional Name: 1-[3-[(2-ketochromene-3-carbonyl)amino]phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylic acid ethyl ester Formula: C23H16F3N3O5 MolecularWeight: 471.38545

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)C3=CC4=CC=CC=C4OC3=O)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)C3=CC4=CC=CC=C4OC3=O)C(F)(F)F

InChI

InChI=1S/C23H16F3N3O5/c1-2-33-21(31)17-12-27-29(19(17)23(24,25)26)15-8-5-7-14(11-15)28-20(30)16-10-13-6-3-4-9-18(13)34-22(16)32/h3-12H,2H2,1H3,(H,28,30)