ethyl 2-[5-(4-cyanophenyl)carbonyl-1-methyl-pyrrol-2-yl]ethanoate

Systemtic Name: ethyl 2-[5-(4-cyanophenyl)carbonyl-1-methyl-pyrrol-2-yl]ethanoate Openeye Name: ethyl 2-[5-(4-cyanobenzoyl)-1-methyl-pyrrol-2-yl]acetate CAS Name: 2-[5-[(4-cyanophenyl)-oxomethyl]-1-methyl-2-pyrrolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-(4-cyanobenzoyl)-1-methylpyrrol-2-yl]acetate Traditional Name: 2-[5-(4-cyanobenzoyl)-1-methyl-pyrrol-2-yl]acetic acid ethyl ester Formula: C17H16N2O3 MolecularWeight: 296.32054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC=C(N1C)C(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCOC(=O)CC1=CC=C(N1C)C(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C17H16N2O3/c1-3-22-16(20)10-14-8-9-15(19(14)2)17(21)13-6-4-12(11-18)5-7-13/h4-9H,3,10H2,1-2H3