N-[(4-methylphenyl)methyl]-3-nitro-5-(trifluoromethyl)pyridin-2-amine

Systemtic Name: N-[(4-methylphenyl)methyl]-3-nitro-5-(trifluoromethyl)pyridin-2-amine Openeye Name: 3-nitro-N-(p-tolylmethyl)-5-(trifluoromethyl)pyridin-2-amine CAS Name: N-[(4-methylphenyl)methyl]-3-nitro-5-(trifluoromethyl)-2-pyridinamine IUPAC Name: N-[(4-methylphenyl)methyl]-3-nitro-5-(trifluoromethyl)pyridin-2-amine Traditional Name: (4-methylbenzyl)-[3-nitro-5-(trifluoromethyl)-2-pyridyl]amine Formula: C14H12F3N3O2 MolecularWeight: 311.25919

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=C(C=C(C=N2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=C(C=C(C=N2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H12F3N3O2/c1-9-2-4-10(5-3-9)7-18-13-12(20(21)22)6-11(8-19-13)14(15,16)17/h2-6,8H,7H2,1H3,(H,18,19)