phenyl 2,3,5-tris(bromanyl)-4-cyano-pyrrole-1-carboxylate

Systemtic Name: phenyl 2,3,5-tris(bromanyl)-4-cyano-pyrrole-1-carboxylate Openeye Name: phenyl 2,3,5-tribromo-4-cyano-pyrrole-1-carboxylate CAS Name: 2,3,5-tribromo-4-cyano-1-pyrrolecarboxylic acid phenyl ester IUPAC Name: phenyl 2,3,5-tribromo-4-cyanopyrrole-1-carboxylate Traditional Name: 2,3,5-tribromo-4-cyano-pyrrole-1-carboxylic acid phenyl ester Formula: C12H5Br3N2O2 MolecularWeight: 448.8923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H5Br3N2O2/c13-9-8(6-16)10(14)17(11(9)15)12(18)19-7-4-2-1-3-5-7/h1-5H