methyl 4-(4-cyano-5-methyl-1H-pyrrol-3-yl)benzoate

Systemtic Name: methyl 4-(4-cyano-5-methyl-1H-pyrrol-3-yl)benzoate Openeye Name: methyl 4-(4-cyano-5-methyl-1H-pyrrol-3-yl)benzoate CAS Name: 4-(4-cyano-5-methyl-1H-pyrrol-3-yl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-cyano-5-methyl-1H-pyrrol-3-yl)benzoate Traditional Name: 4-(4-cyano-5-methyl-1H-pyrrol-3-yl)benzoic acid methyl ester Formula: C14H12N2O2 MolecularWeight: 240.25728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CN1)C2=CC=C(C=C2)C(=O)OC)C#N

Isomeric SMILES

CC1=C(C(=CN1)C2=CC=C(C=C2)C(=O)OC)C#N

InChI

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