3-nitro-5-[2,3,6-tris(fluoranyl)-4-methyl-phenyl]-1H-pyrrole-2-carbonitrile

Systemtic Name: 3-nitro-5-[2,3,6-tris(fluoranyl)-4-methyl-phenyl]-1H-pyrrole-2-carbonitrile Openeye Name: 3-nitro-5-(2,3,6-trifluoro-4-methyl-phenyl)-1H-pyrrole-2-carbonitrile CAS Name: 3-nitro-5-(2,3,6-trifluoro-4-methylphenyl)-1H-pyrrole-2-carbonitrile IUPAC Name: 3-nitro-5-(2,3,6-trifluoro-4-methylphenyl)-1H-pyrrole-2-carbonitrile Traditional Name: 3-nitro-5-(2,3,6-trifluoro-4-methyl-phenyl)-1H-pyrrole-2-carbonitrile Formula: C12H6F3N3O2 MolecularWeight: 281.19015

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1F)F)C2=CC(=C(N2)C#N)[N+](=O)[O-])F

Isomeric SMILES

CC1=CC(=C(C(=C1F)F)C2=CC(=C(N2)C#N)[N+](=O)[O-])F

InChI

InChI=1S/C12H6F3N3O2/c1-5-2-6(13)10(12(15)11(5)14)7-3-9(18(19)20)8(4-16)17-7/h2-3,17H,1H3