[(1E,3R,4R,5E)-6-chloranyl-1-(4-methoxyphenyl)-4-(4-methylphenyl)sulfonyl-hexa-1,5-dien-3-yl] ethanoate

Systemtic Name: [(1E,3R,4R,5E)-6-chloranyl-1-(4-methoxyphenyl)-4-(4-methylphenyl)sulfonyl-hexa-1,5-dien-3-yl] ethanoate Openeye Name: [(E,1R,2R)-4-chloro-1-[(E)-2-(4-methoxyphenyl)vinyl]-2-(p-tolylsulfonyl)but-3-enyl] acetate CAS Name: acetic acid [(1E,3R,4R,5E)-6-chloro-1-(4-methoxyphenyl)-4-(4-methylphenyl)sulfonylhexa-1,5-dien-3-yl] ester IUPAC Name: [(1E,3R,4R,5E)-6-chloro-1-(4-methoxyphenyl)-4-(4-methylphenyl)sulfonylhexa-1,5-dien-3-yl] acetate Traditional Name: acetic acid [(E,1R,2R)-4-chloro-1-[(E)-2-(4-methoxyphenyl)vinyl]-2-tosyl-but-3-enyl] ester Formula: C22H23ClO5S MolecularWeight: 434.93302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C=CCl)C(C=CC2=CC=C(C=C2)OC)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[C@H](/C=C/Cl)[C@@H](/C=C/C2=CC=C(C=C2)OC)OC(=O)C

InChI

InChI=1S/C22H23ClO5S/c1-16-4-11-20(12-5-16)29(25,26)22(14-15-23)21(28-17(2)24)13-8-18-6-9-19(27-3)10-7-18/h4-15,21-22H,1-3H3/b13-8+,15-14+/t21-,22-/m1/s1