N-(4-methylphenyl)-2,4-dinitro-N-propyl-6-(trifluoromethyl)aniline

Systemtic Name: N-(4-methylphenyl)-2,4-dinitro-N-propyl-6-(trifluoromethyl)aniline Openeye Name: 2,4-dinitro-N-propyl-N-(p-tolyl)-6-(trifluoromethyl)aniline CAS Name: N-(4-methylphenyl)-2,4-dinitro-N-propyl-6-(trifluoromethyl)aniline IUPAC Name: N-(4-methylphenyl)-2,4-dinitro-N-propyl-6-(trifluoromethyl)aniline Traditional Name: [2,4-dinitro-6-(trifluoromethyl)phenyl]-propyl-(p-tolyl)amine Formula: C17H16F3N3O4 MolecularWeight: 383.32185

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC=C(C=C1)C)C2=C(C=C(C=C2C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCN(C1=CC=C(C=C1)C)C2=C(C=C(C=C2C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H16F3N3O4/c1-3-8-21(12-6-4-11(2)5-7-12)16-14(17(18,19)20)9-13(22(24)25)10-15(16)23(26)27/h4-7,9-10H,3,8H2,1-2H3