methyl 3-[(Z)-2-dodecylsulfanylethenyl]benzoate

Systemtic Name: methyl 3-[(Z)-2-dodecylsulfanylethenyl]benzoate Openeye Name: methyl 3-[(Z)-2-dodecylsulfanylvinyl]benzoate CAS Name: 3-[(Z)-2-(dodecylthio)ethenyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(Z)-2-dodecylsulfanylethenyl]benzoate Traditional Name: 3-[(Z)-2-(laurylthio)vinyl]benzoic acid methyl ester Formula: C22H34O2S MolecularWeight: 362.56916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC=CC1=CC(=CC=C1)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCS/C=C\C1=CC(=CC=C1)C(=O)OC

InChI

InChI=1S/C22H34O2S/c1-3-4-5-6-7-8-9-10-11-12-17-25-18-16-20-14-13-15-21(19-20)22(23)24-2/h13-16,18-19H,3-12,17H2,1-2H3/b18-16-