N-(4-butan-2-ylphenyl)-2-nitro-4-(trifluoromethyl)aniline

Systemtic Name: N-(4-butan-2-ylphenyl)-2-nitro-4-(trifluoromethyl)aniline Openeye Name: 2-nitro-N-(4-sec-butylphenyl)-4-(trifluoromethyl)aniline CAS Name: N-(4-butan-2-ylphenyl)-2-nitro-4-(trifluoromethyl)aniline IUPAC Name: N-(4-butan-2-ylphenyl)-2-nitro-4-(trifluoromethyl)aniline Traditional Name: [2-nitro-4-(trifluoromethyl)phenyl]-(4-sec-butylphenyl)amine Formula: C17H17F3N2O2 MolecularWeight: 338.32429

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C17H17F3N2O2/c1-3-11(2)12-4-7-14(8-5-12)21-15-9-6-13(17(18,19)20)10-16(15)22(23)24/h4-11,21H,3H2,1-2H3