3-nitro-5-[4-(trifluoromethyl)phenyl]-1H-pyrrole-2-carbonitrile

Systemtic Name: 3-nitro-5-[4-(trifluoromethyl)phenyl]-1H-pyrrole-2-carbonitrile Openeye Name: 3-nitro-5-[4-(trifluoromethyl)phenyl]-1H-pyrrole-2-carbonitrile CAS Name: 3-nitro-5-[4-(trifluoromethyl)phenyl]-1H-pyrrole-2-carbonitrile IUPAC Name: 3-nitro-5-[4-(trifluoromethyl)phenyl]-1H-pyrrole-2-carbonitrile Traditional Name: 3-nitro-5-[4-(trifluoromethyl)phenyl]-1H-pyrrole-2-carbonitrile Formula: C12H6F3N3O2 MolecularWeight: 281.19015

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=C(N2)C#N)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=C(N2)C#N)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C12H6F3N3O2/c13-12(14,15)8-3-1-7(2-4-8)9-5-11(18(19)20)10(6-16)17-9/h1-5,17H