ethyl (E)-3-[3-[imidazol-1-yl-(4-methylphenyl)methyl]pyrrol-1-yl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[3-[imidazol-1-yl-(4-methylphenyl)methyl]pyrrol-1-yl]prop-2-enoate Openeye Name: ethyl (E)-3-[3-[imidazol-1-yl(p-tolyl)methyl]pyrrol-1-yl]prop-2-enoate CAS Name: (E)-3-[3-[1-imidazolyl-(4-methylphenyl)methyl]-1-pyrrolyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[3-[imidazol-1-yl-(4-methylphenyl)methyl]pyrrol-1-yl]prop-2-enoate Traditional Name: (E)-3-[3-[imidazol-1-yl(p-tolyl)methyl]pyrrol-1-yl]acrylic acid ethyl ester Formula: C20H21N3O2 MolecularWeight: 335.39964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CN1C=CC(=C1)C(C2=CC=C(C=C2)C)N3C=CN=C3

Isomeric SMILES

CCOC(=O)/C=C/N1C=CC(=C1)C(C2=CC=C(C=C2)C)N3C=CN=C3

InChI

InChI=1S/C20H21N3O2/c1-3-25-19(24)9-12-22-11-8-18(14-22)20(23-13-10-21-15-23)17-6-4-16(2)5-7-17/h4-15,20H,3H2,1-2H3/b12-9+