4-[4-[(E)-2-(4-methylsulfonylphenyl)ethenyl]phenoxy]butyl butanoate

Systemtic Name: 4-[4-[(E)-2-(4-methylsulfonylphenyl)ethenyl]phenoxy]butyl butanoate Openeye Name: 4-[4-[(E)-2-(4-methylsulfonylphenyl)vinyl]phenoxy]butyl butanoate CAS Name: butanoic acid 4-[4-[(E)-2-(4-methylsulfonylphenyl)ethenyl]phenoxy]butyl ester IUPAC Name: 4-[4-[(E)-2-(4-methylsulfonylphenyl)ethenyl]phenoxy]butyl butanoate Traditional Name: butyric acid 4-[4-[(E)-2-(4-mesylphenyl)vinyl]phenoxy]butyl ester Formula: C23H28O5S MolecularWeight: 416.53042

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCCCCOC1=CC=C(C=C1)C=CC2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CCCC(=O)OCCCCOC1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C23H28O5S/c1-3-6-23(24)28-18-5-4-17-27-21-13-9-19(10-14-21)7-8-20-11-15-22(16-12-20)29(2,25)26/h7-16H,3-6,17-18H2,1-2H3/b8-7+