2-azanyl-1-[2,4-bis(bromanyl)-6-(trifluoromethyloxy)phenyl]-4-methyl-pyrrole-3-carbonitrile

Systemtic Name: 2-azanyl-1-[2,4-bis(bromanyl)-6-(trifluoromethyloxy)phenyl]-4-methyl-pyrrole-3-carbonitrile Openeye Name: 2-amino-1-[2,4-dibromo-6-(trifluoromethoxy)phenyl]-4-methyl-pyrrole-3-carbonitrile CAS Name: 2-amino-1-[2,4-dibromo-6-(trifluoromethoxy)phenyl]-4-methyl-3-pyrrolecarbonitrile IUPAC Name: 2-amino-1-[2,4-dibromo-6-(trifluoromethoxy)phenyl]-4-methylpyrrole-3-carbonitrile Traditional Name: 2-amino-1-[2,4-dibromo-6-(trifluoromethoxy)phenyl]-4-methyl-pyrrole-3-carbonitrile Formula: C13H8Br2F3N3O MolecularWeight: 439.02533

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=C1C#N)N)C2=C(C=C(C=C2OC(F)(F)F)Br)Br

Isomeric SMILES

CC1=CN(C(=C1C#N)N)C2=C(C=C(C=C2OC(F)(F)F)Br)Br

InChI

InChI=1S/C13H8Br2F3N3O/c1-6-5-21(12(20)8(6)4-19)11-9(15)2-7(14)3-10(11)22-13(16,17)18/h2-3,5H,20H2,1H3