ethyl 4-(2-cyano-4,5-dimethyl-1H-pyrrol-3-yl)benzoate

Systemtic Name: ethyl 4-(2-cyano-4,5-dimethyl-1H-pyrrol-3-yl)benzoate Openeye Name: ethyl 4-(2-cyano-4,5-dimethyl-1H-pyrrol-3-yl)benzoate CAS Name: 4-(2-cyano-4,5-dimethyl-1H-pyrrol-3-yl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(2-cyano-4,5-dimethyl-1H-pyrrol-3-yl)benzoate Traditional Name: 4-(2-cyano-4,5-dimethyl-1H-pyrrol-3-yl)benzoic acid ethyl ester Formula: C16H16N2O2 MolecularWeight: 268.31044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=C(NC(=C2C)C)C#N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=C(NC(=C2C)C)C#N

InChI

InChI=1S/C16H16N2O2/c1-4-20-16(19)13-7-5-12(6-8-13)15-10(2)11(3)18-14(15)9-17/h5-8,18H,4H2,1-3H3