5,7-dinitro-2-(trifluoromethyl)-1H-indole-3-carbonitrile

Systemtic Name: 5,7-dinitro-2-(trifluoromethyl)-1H-indole-3-carbonitrile Openeye Name: 5,7-dinitro-2-(trifluoromethyl)-1H-indole-3-carbonitrile CAS Name: 5,7-dinitro-2-(trifluoromethyl)-1H-indole-3-carbonitrile IUPAC Name: 5,7-dinitro-2-(trifluoromethyl)-1H-indole-3-carbonitrile Traditional Name: 5,7-dinitro-2-(trifluoromethyl)-1H-indole-3-carbonitrile Formula: C10H3F3N4O4 MolecularWeight: 300.15043

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C2C(=C(NC2=C1[N+](=O)[O-])C(F)(F)F)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C2C(=C(NC2=C1[N+](=O)[O-])C(F)(F)F)C#N)[N+](=O)[O-]

InChI

InChI=1S/C10H3F3N4O4/c11-10(12,13)9-6(3-14)5-1-4(16(18)19)2-7(17(20)21)8(5)15-9/h1-2,15H