methyl N'-(pyridin-2-ylmethyl)-N-[4-(trifluoromethyl)phenyl]carbonyl-carbamimidate

Systemtic Name: methyl N'-(pyridin-2-ylmethyl)-N-[4-(trifluoromethyl)phenyl]carbonyl-carbamimidate Openeye Name: N-[C-methoxy-N-(2-pyridylmethyl)carbonimidoyl]-4-(trifluoromethyl)benzamide CAS Name: N-[oxo-[4-(trifluoromethyl)phenyl]methyl]-N'-(2-pyridinylmethyl)carbamimidic acid methyl ester IUPAC Name: methyl N'-(pyridin-2-ylmethyl)-N-[4-(trifluoromethyl)benzoyl]carbamimidate Traditional Name: N-[C-methoxy-N-(2-pyridylmethyl)carbonimidoyl]-4-(trifluoromethyl)benzamide Formula: C16H14F3N3O2 MolecularWeight: 337.29647

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Descriptors Computed from Structure

Canonical SMILES:

COC(=NCC1=CC=CC=N1)NC(=O)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

COC(=NCC1=CC=CC=N1)NC(=O)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C16H14F3N3O2/c1-24-15(21-10-13-4-2-3-9-20-13)22-14(23)11-5-7-12(8-6-11)16(17,18)19/h2-9H,10H2,1H3,(H,21,22,23)