2-[2-[(4-ethenylphenyl)methylsulfanyl]ethyl]butanedioic acid

Systemtic Name: 2-[2-[(4-ethenylphenyl)methylsulfanyl]ethyl]butanedioic acid Openeye Name: 2-[2-[(4-vinylphenyl)methylsulfanyl]ethyl]butanedioic acid CAS Name: 2-[2-[(4-ethenylphenyl)methylthio]ethyl]butanedioic acid IUPAC Name: 2-[2-[(4-ethenylphenyl)methylsulfanyl]ethyl]butanedioic acid Traditional Name: 2-[2-[(4-vinylbenzyl)thio]ethyl]succinic acid Formula: C15H18O4S MolecularWeight: 294.36602

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=C(C=C1)CSCCC(CC(=O)O)C(=O)O

Isomeric SMILES

C=CC1=CC=C(C=C1)CSCCC(CC(=O)O)C(=O)O

InChI

InChI=1S/C15H18O4S/c1-2-11-3-5-12(6-4-11)10-20-8-7-13(15(18)19)9-14(16)17/h2-6,13H,1,7-10H2,(H,16,17)(H,18,19)