3-[4-[(E)-2-(4-octadecoxyphenyl)ethenyl]phenyl]sulfonylpropyl 2-methylprop-2-enoate

Systemtic Name: 3-[4-[(E)-2-(4-octadecoxyphenyl)ethenyl]phenyl]sulfonylpropyl 2-methylprop-2-enoate Openeye Name: 3-[4-[(E)-2-(4-octadecoxyphenyl)vinyl]phenyl]sulfonylpropyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid 3-[4-[(E)-2-(4-octadecoxyphenyl)ethenyl]phenyl]sulfonylpropyl ester IUPAC Name: 3-[4-[(E)-2-(4-octadecoxyphenyl)ethenyl]phenyl]sulfonylpropyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid 3-[4-[(E)-2-(4-stearyloxyphenyl)vinyl]phenyl]sulfonylpropyl ester Formula: C39H58O5S MolecularWeight: 638.93982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C=CC2=CC=C(C=C2)S(=O)(=O)CCCOC(=O)C(=C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)S(=O)(=O)CCCOC(=O)C(=C)C

InChI

InChI=1S/C39H58O5S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-31-43-37-27-23-35(24-28-37)21-22-36-25-29-38(30-26-36)45(41,42)33-20-32-44-39(40)34(2)3/h21-30H,2,4-20,31-33H2,1,3H3/b22-21+