ethyl 2-[5-(4-cyanophenyl)carbonyl-1,4-dimethyl-pyrrol-2-yl]propanoate

Systemtic Name: ethyl 2-[5-(4-cyanophenyl)carbonyl-1,4-dimethyl-pyrrol-2-yl]propanoate Openeye Name: ethyl 2-[5-(4-cyanobenzoyl)-1,4-dimethyl-pyrrol-2-yl]propanoate CAS Name: 2-[5-[(4-cyanophenyl)-oxomethyl]-1,4-dimethyl-2-pyrrolyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-[5-(4-cyanobenzoyl)-1,4-dimethylpyrrol-2-yl]propanoate Traditional Name: 2-[5-(4-cyanobenzoyl)-1,4-dimethyl-pyrrol-2-yl]propionic acid ethyl ester Formula: C19H20N2O3 MolecularWeight: 324.3737

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)C1=CC(=C(N1C)C(=O)C2=CC=C(C=C2)C#N)C

Isomeric SMILES

CCOC(=O)C(C)C1=CC(=C(N1C)C(=O)C2=CC=C(C=C2)C#N)C

InChI

InChI=1S/C19H20N2O3/c1-5-24-19(23)13(3)16-10-12(2)17(21(16)4)18(22)15-8-6-14(11-20)7-9-15/h6-10,13H,5H2,1-4H3