[4-(1,2,4-triazol-1-yl)-2-(trifluoromethyl)phenyl]methanamine

Systemtic Name: [4-(1,2,4-triazol-1-yl)-2-(trifluoromethyl)phenyl]methanamine Openeye Name: [4-(1,2,4-triazol-1-yl)-2-(trifluoromethyl)phenyl]methanamine CAS Name: [4-(1,2,4-triazol-1-yl)-2-(trifluoromethyl)phenyl]methanamine IUPAC Name: [4-(1,2,4-triazol-1-yl)-2-(trifluoromethyl)phenyl]methanamine Traditional Name: [4-(1,2,4-triazol-1-yl)-2-(trifluoromethyl)benzyl]amine Formula: C10H9F3N4 MolecularWeight: 242.20047

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N2C=NC=N2)C(F)(F)F)CN

Isomeric SMILES

C1=CC(=C(C=C1N2C=NC=N2)C(F)(F)F)CN

InChI

InChI=1S/C10H9F3N4/c11-10(12,13)9-3-8(2-1-7(9)4-14)17-6-15-5-16-17/h1-3,5-6H,4,14H2