2,4,5-tris(bromanyl)-1-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]pyrrole-3-carbonitrile

Systemtic Name: 2,4,5-tris(bromanyl)-1-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]pyrrole-3-carbonitrile Openeye Name: 2,4,5-tribromo-1-[2-(4-chlorophenyl)-2-oxo-ethyl]pyrrole-3-carbonitrile CAS Name: 2,4,5-tribromo-1-[2-(4-chlorophenyl)-2-oxoethyl]-3-pyrrolecarbonitrile IUPAC Name: 2,4,5-tribromo-1-[2-(4-chlorophenyl)-2-oxoethyl]pyrrole-3-carbonitrile Traditional Name: 2,4,5-tribromo-1-[2-(4-chlorophenyl)-2-keto-ethyl]pyrrole-3-carbonitrile Formula: C13H6Br3ClN2O MolecularWeight: 481.36454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CN2C(=C(C(=C2Br)Br)C#N)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)CN2C(=C(C(=C2Br)Br)C#N)Br)Cl

InChI

InChI=1S/C13H6Br3ClN2O/c14-11-9(5-18)12(15)19(13(11)16)6-10(20)7-1-3-8(17)4-2-7/h1-4H,6H2