methyl 4-(2-chloranyl-4-cyano-1-methyl-pyrrol-3-yl)benzoate

Systemtic Name: methyl 4-(2-chloranyl-4-cyano-1-methyl-pyrrol-3-yl)benzoate Openeye Name: methyl 4-(2-chloro-4-cyano-1-methyl-pyrrol-3-yl)benzoate CAS Name: 4-(2-chloro-4-cyano-1-methyl-3-pyrrolyl)benzoic acid methyl ester IUPAC Name: methyl 4-(2-chloro-4-cyano-1-methylpyrrol-3-yl)benzoate Traditional Name: 4-(2-chloro-4-cyano-1-methyl-pyrrol-3-yl)benzoic acid methyl ester Formula: C14H11ClN2O2 MolecularWeight: 274.70234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11ClN2O2/c1-17-8-11(7-16)12(13(17)15)9-3-5-10(6-4-9)14(18)19-2/h3-6,8H,1-2H3