cyanomethyl 4-(2,5-dimethylpyrrol-1-yl)benzoate

Systemtic Name: cyanomethyl 4-(2,5-dimethylpyrrol-1-yl)benzoate Openeye Name: cyanomethyl 4-(2,5-dimethylpyrrol-1-yl)benzoate CAS Name: 4-(2,5-dimethyl-1-pyrrolyl)benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 4-(2,5-dimethylpyrrol-1-yl)benzoate Traditional Name: 4-(2,5-dimethylpyrrol-1-yl)benzoic acid cyanomethyl ester Formula: C15H14N2O2 MolecularWeight: 254.28386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14N2O2/c1-11-3-4-12(2)17(11)14-7-5-13(6-8-14)15(18)19-10-9-16/h3-8H,10H2,1-2H3