methyl 3-(2-cyano-5-methyl-pyrrol-1-yl)benzoate

Systemtic Name: methyl 3-(2-cyano-5-methyl-pyrrol-1-yl)benzoate Openeye Name: methyl 3-(2-cyano-5-methyl-pyrrol-1-yl)benzoate CAS Name: 3-(2-cyano-5-methyl-1-pyrrolyl)benzoic acid methyl ester IUPAC Name: methyl 3-(2-cyano-5-methylpyrrol-1-yl)benzoate Traditional Name: 3-(2-cyano-5-methyl-pyrrol-1-yl)benzoic acid methyl ester Formula: C14H12N2O2 MolecularWeight: 240.25728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=CC(=C2)C(=O)OC)C#N

Isomeric SMILES

CC1=CC=C(N1C2=CC=CC(=C2)C(=O)OC)C#N

InChI

InChI=1S/C14H12N2O2/c1-10-6-7-13(9-15)16(10)12-5-3-4-11(8-12)14(17)18-2/h3-8H,1-2H3