5-azanyl-1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-4-iodanyl-pyrrole-3-carbonitrile

Systemtic Name: 5-azanyl-1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-4-iodanyl-pyrrole-3-carbonitrile Openeye Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-iodo-pyrrole-3-carbonitrile CAS Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-iodo-3-pyrrolecarbonitrile IUPAC Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-iodopyrrole-3-carbonitrile Traditional Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-iodo-pyrrole-3-carbonitrile Formula: C12H5Cl2F3IN3 MolecularWeight: 445.99388

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Cl)N2C=C(C(=C2N)I)C#N)Cl)C(F)(F)F

Isomeric SMILES

C1=C(C=C(C(=C1Cl)N2C=C(C(=C2N)I)C#N)Cl)C(F)(F)F

InChI

InChI=1S/C12H5Cl2F3IN3/c13-7-1-6(12(15,16)17)2-8(14)10(7)21-4-5(3-19)9(18)11(21)20/h1-2,4H,20H2