2-(2-ethanoylphenoxy)ethyl (E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enoate

Systemtic Name: 2-(2-ethanoylphenoxy)ethyl (E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enoate Openeye Name: 2-(2-acetylphenoxy)ethyl (E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]prop-2-enoate CAS Name: (E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-2-propenoic acid 2-(2-acetylphenoxy)ethyl ester IUPAC Name: 2-(2-acetylphenoxy)ethyl (E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]acrylic acid 2-(2-acetylphenoxy)ethyl ester Formula: C27H26N2O5 MolecularWeight: 458.50574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C=C(C#N)C(=O)OCCOC3=CC=CC=C3C(=O)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)/C=C(\C#N)/C(=O)OCCOC3=CC=CC=C3C(=O)C

InChI

InChI=1S/C27H26N2O5/c1-18-15-21(19(2)29(18)23-9-11-24(32-4)12-10-23)16-22(17-28)27(31)34-14-13-33-26-8-6-5-7-25(26)20(3)30/h5-12,15-16H,13-14H2,1-4H3/b22-16+