ethyl 2-[2-(2,6-dimethoxyphenyl)carbonylhydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[2-(2,6-dimethoxyphenyl)carbonylhydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate Openeye Name: ethyl 2-[2-(2,6-dimethoxybenzoyl)hydrazino]-4-(trifluoromethyl)pyrimidine-5-carboxylate CAS Name: 2-[[(2,6-dimethoxyphenyl)-oxomethyl]hydrazo]-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(2,6-dimethoxybenzoyl)hydrazinyl]-4-(trifluoromethyl)pyrimidine-5-carboxylate Traditional Name: 2-[N'-(2,6-dimethoxybenzoyl)hydrazino]-4-(trifluoromethyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C17H17F3N4O5 MolecularWeight: 414.33589

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1C(F)(F)F)NNC(=O)C2=C(C=CC=C2OC)OC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1C(F)(F)F)NNC(=O)C2=C(C=CC=C2OC)OC

InChI

InChI=1S/C17H17F3N4O5/c1-4-29-15(26)9-8-21-16(22-13(9)17(18,19)20)24-23-14(25)12-10(27-2)6-5-7-11(12)28-3/h5-8H,4H2,1-3H3,(H,23,25)(H,21,22,24)