N-(heptan-4-ylideneamino)-2-nitro-4-(trifluoromethyl)aniline

Systemtic Name: N-(heptan-4-ylideneamino)-2-nitro-4-(trifluoromethyl)aniline Openeye Name: 2-nitro-N-(1-propylbutylideneamino)-4-(trifluoromethyl)aniline CAS Name: N-(heptan-4-ylideneamino)-2-nitro-4-(trifluoromethyl)aniline IUPAC Name: N-(heptan-4-ylideneamino)-2-nitro-4-(trifluoromethyl)aniline Traditional Name: [2-nitro-4-(trifluoromethyl)phenyl]-(1-propylbutylideneamino)amine Formula: C14H18F3N3O2 MolecularWeight: 317.30683

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NNC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-])CCC

Isomeric SMILES

CCCC(=NNC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-])CCC

InChI

InChI=1S/C14H18F3N3O2/c1-3-5-11(6-4-2)18-19-12-8-7-10(14(15,16)17)9-13(12)20(21)22/h7-9,19H,3-6H2,1-2H3