(1-cyanoindolizin-2-yl)methyl (E)-3-(4-ethoxy-3-methoxy-phenyl)prop-2-enoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl (E)-3-(4-ethoxy-3-methoxy-phenyl)prop-2-enoate Openeye Name: (1-cyanoindolizin-2-yl)methyl (E)-3-(4-ethoxy-3-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(4-ethoxy-3-methoxyphenyl)-2-propenoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl (E)-3-(4-ethoxy-3-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-ethoxy-3-methoxy-phenyl)acrylic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C22H20N2O4 MolecularWeight: 376.4052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=CC(=O)OCC2=CN3C=CC=CC3=C2C#N)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=C/C(=O)OCC2=CN3C=CC=CC3=C2C#N)OC

InChI

InChI=1S/C22H20N2O4/c1-3-27-20-9-7-16(12-21(20)26-2)8-10-22(25)28-15-17-14-24-11-5-4-6-19(24)18(17)13-23/h4-12,14H,3,15H2,1-2H3/b10-8+