2,4,5-tris(bromanyl)-1-(phenylmethyl)pyrrole-3-carbonitrile

Systemtic Name: 2,4,5-tris(bromanyl)-1-(phenylmethyl)pyrrole-3-carbonitrile Openeye Name: 1-benzyl-2,4,5-tribromo-pyrrole-3-carbonitrile CAS Name: 2,4,5-tribromo-1-(phenylmethyl)-3-pyrrolecarbonitrile IUPAC Name: 1-benzyl-2,4,5-tribromopyrrole-3-carbonitrile Traditional Name: 1-benzyl-2,4,5-tribromo-pyrrole-3-carbonitrile Formula: C12H7Br3N2 MolecularWeight: 418.90938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=C(C(=C2Br)Br)C#N)Br

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=C(C(=C2Br)Br)C#N)Br

InChI

InChI=1S/C12H7Br3N2/c13-10-9(6-16)11(14)17(12(10)15)7-8-4-2-1-3-5-8/h1-5H,7H2