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

Systemtic Name: ethyl 2-[5-(4-cyanophenyl)carbonyl-1,4-dimethyl-pyrrol-2-yl]ethanoate Openeye Name: ethyl 2-[5-(4-cyanobenzoyl)-1,4-dimethyl-pyrrol-2-yl]acetate CAS Name: 2-[5-[(4-cyanophenyl)-oxomethyl]-1,4-dimethyl-2-pyrrolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-(4-cyanobenzoyl)-1,4-dimethylpyrrol-2-yl]acetate Traditional Name: 2-[5-(4-cyanobenzoyl)-1,4-dimethyl-pyrrol-2-yl]acetic acid ethyl ester Formula: C18H18N2O3 MolecularWeight: 310.34712

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)C

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O3/c1-4-23-16(21)10-15-9-12(2)17(20(15)3)18(22)14-7-5-13(11-19)6-8-14/h5-9H,4,10H2,1-3H3