(3-morpholin-4-ylsulfonylphenyl)methyl (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate Openeye Name: (3-morpholinosulfonylphenyl)methyl (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(2,4,5-trimethoxyphenyl)-2-propenoic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl (E)-3-(2,4,5-trimethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-asarylacrylic acid (3-morpholinosulfonylbenzyl) ester Formula: C23H27NO8S MolecularWeight: 477.52738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=CC(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1/C=C/C(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)OC)OC

InChI

InChI=1S/C23H27NO8S/c1-28-20-15-22(30-3)21(29-2)14-18(20)7-8-23(25)32-16-17-5-4-6-19(13-17)33(26,27)24-9-11-31-12-10-24/h4-8,13-15H,9-12,16H2,1-3H3/b8-7+