ethyl 4-(2-cyano-5-methanoyl-4-methyl-1H-pyrrol-3-yl)benzoate

Systemtic Name: ethyl 4-(2-cyano-5-methanoyl-4-methyl-1H-pyrrol-3-yl)benzoate Openeye Name: ethyl 4-(2-cyano-5-formyl-4-methyl-1H-pyrrol-3-yl)benzoate CAS Name: 4-(2-cyano-5-formyl-4-methyl-1H-pyrrol-3-yl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(2-cyano-5-formyl-4-methyl-1H-pyrrol-3-yl)benzoate Traditional Name: 4-(2-cyano-5-formyl-4-methyl-1H-pyrrol-3-yl)benzoic acid ethyl ester Formula: C16H14N2O3 MolecularWeight: 282.29396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O3/c1-3-21-16(20)12-6-4-11(5-7-12)15-10(2)14(9-19)18-13(15)8-17/h4-7,9,18H,3H2,1-2H3