N-[bis(azanyl)methylidene]-4-pyridin-3-yloxy-3-(trifluoromethyl)benzamide dihydrochloride

Systemtic Name: N-[bis(azanyl)methylidene]-4-pyridin-3-yloxy-3-(trifluoromethyl)benzamide dihydrochloride Openeye Name: N-(diaminomethylene)-4-(3-pyridyloxy)-3-(trifluoromethyl)benzamide dihydrochloride CAS Name: N-(diaminomethylidene)-4-(3-pyridinyloxy)-3-(trifluoromethyl)benzamide dihydrochloride IUPAC Name: N-(diaminomethylidene)-4-pyridin-3-yloxy-3-(trifluoromethyl)benzamide dihydrochloride Traditional Name: N-(diaminomethylene)-4-(3-pyridyloxy)-3-(trifluoromethyl)benzamide dihydrochloride Formula: C14H13Cl2F3N4O2 MolecularWeight: 397.17983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)OC2=C(C=C(C=C2)C(=O)N=C(N)N)C(F)(F)F.Cl.Cl

Isomeric SMILES

C1=CC(=CN=C1)OC2=C(C=C(C=C2)C(=O)N=C(N)N)C(F)(F)F.Cl.Cl

InChI

InChI=1S/C14H11F3N4O2.2ClH/c15-14(16,17)10-6-8(12(22)21-13(18)19)3-4-11(10)23-9-2-1-5-20-7-9;;/h1-7H,(H4,18,19,21,22);2*1H