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

Systemtic Name: 2,4,5-tris(bromanyl)-1-(4-methoxyphenyl)carbonyl-pyrrole-3-carbonitrile Openeye Name: 2,4,5-tribromo-1-(4-methoxybenzoyl)pyrrole-3-carbonitrile CAS Name: 2,4,5-tribromo-1-[(4-methoxyphenyl)-oxomethyl]-3-pyrrolecarbonitrile IUPAC Name: 2,4,5-tribromo-1-(4-methoxybenzoyl)pyrrole-3-carbonitrile Traditional Name: 2,4,5-tribromo-1-p-anisoyl-pyrrole-3-carbonitrile Formula: C13H7Br3N2O2 MolecularWeight: 462.91888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2C(=C(C(=C2Br)Br)C#N)Br

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2C(=C(C(=C2Br)Br)C#N)Br

InChI

InChI=1S/C13H7Br3N2O2/c1-20-8-4-2-7(3-5-8)13(19)18-11(15)9(6-17)10(14)12(18)16/h2-5H,1H3