2-[2-[(4-ethenylphenyl)methylsulfanyl]ethyl]pentanedioate

Systemtic Name: 2-[2-[(4-ethenylphenyl)methylsulfanyl]ethyl]pentanedioate Openeye Name: 2-[2-[(4-vinylphenyl)methylsulfanyl]ethyl]pentanedioate CAS Name: 2-[2-[(4-ethenylphenyl)methylthio]ethyl]pentanedioate IUPAC Name: 2-[2-[(4-ethenylphenyl)methylsulfanyl]ethyl]pentanedioate Traditional Name: 2-[2-[(4-vinylbenzyl)thio]ethyl]glutarate Formula: C16H18O4S-2 MolecularWeight: 306.37672

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=C(C=C1)CSCCC(CCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C=CC1=CC=C(C=C1)CSCCC(CCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C16H20O4S/c1-2-12-3-5-13(6-4-12)11-21-10-9-14(16(19)20)7-8-15(17)18/h2-6,14H,1,7-11H2,(H,17,18)(H,19,20)/p-2