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

Systemtic Name: methyl 4-(4-cyano-1,2-dimethyl-pyrrol-3-yl)benzoate Openeye Name: methyl 4-(4-cyano-1,2-dimethyl-pyrrol-3-yl)benzoate CAS Name: 4-(4-cyano-1,2-dimethyl-3-pyrrolyl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-cyano-1,2-dimethylpyrrol-3-yl)benzoate Traditional Name: 4-(4-cyano-1,2-dimethyl-pyrrol-3-yl)benzoic acid methyl ester Formula: C15H14N2O2 MolecularWeight: 254.28386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CN1C)C#N)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(=CN1C)C#N)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C15H14N2O2/c1-10-14(13(8-16)9-17(10)2)11-4-6-12(7-5-11)15(18)19-3/h4-7,9H,1-3H3