3-[[2,4-dinitro-6-(trifluoromethyl)phenyl]amino]naphthalene-1-carbonitrile

Systemtic Name: 3-[[2,4-dinitro-6-(trifluoromethyl)phenyl]amino]naphthalene-1-carbonitrile Openeye Name: 3-[2,4-dinitro-6-(trifluoromethyl)anilino]naphthalene-1-carbonitrile CAS Name: 3-[2,4-dinitro-6-(trifluoromethyl)anilino]-1-naphthalenecarbonitrile IUPAC Name: 3-[2,4-dinitro-6-(trifluoromethyl)anilino]naphthalene-1-carbonitrile Traditional Name: 3-[2,4-dinitro-6-(trifluoromethyl)anilino]naphthalene-1-carbonitrile Formula: C18H9F3N4O4 MolecularWeight: 402.28367

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=C2C#N)NC3=C(C=C(C=C3C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=C2C#N)NC3=C(C=C(C=C3C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H9F3N4O4/c19-18(20,21)15-7-13(24(26)27)8-16(25(28)29)17(15)23-12-5-10-3-1-2-4-14(10)11(6-12)9-22/h1-8,23H