methyl 4-[2,5-bis(chloranyl)-4-cyano-1-methyl-pyrrol-3-yl]benzoate

Systemtic Name: methyl 4-[2,5-bis(chloranyl)-4-cyano-1-methyl-pyrrol-3-yl]benzoate Openeye Name: methyl 4-(2,5-dichloro-4-cyano-1-methyl-pyrrol-3-yl)benzoate CAS Name: 4-(2,5-dichloro-4-cyano-1-methyl-3-pyrrolyl)benzoic acid methyl ester IUPAC Name: methyl 4-(2,5-dichloro-4-cyano-1-methylpyrrol-3-yl)benzoate Traditional Name: 4-(2,5-dichloro-4-cyano-1-methyl-pyrrol-3-yl)benzoic acid methyl ester Formula: C14H10Cl2N2O2 MolecularWeight: 309.1474

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=C1Cl)C2=CC=C(C=C2)C(=O)OC)C#N)Cl

Isomeric SMILES

CN1C(=C(C(=C1Cl)C2=CC=C(C=C2)C(=O)OC)C#N)Cl

InChI

InChI=1S/C14H10Cl2N2O2/c1-18-12(15)10(7-17)11(13(18)16)8-3-5-9(6-4-8)14(19)20-2/h3-6H,1-2H3