dimethyl 2-phenylsulfanylhexanedioate

Systemtic Name: dimethyl 2-phenylsulfanylhexanedioate Openeye Name: dimethyl 2-phenylsulfanylhexanedioate CAS Name: 2-(phenylthio)hexanedioic acid dimethyl ester IUPAC Name: dimethyl 2-phenylsulfanylhexanedioate Traditional Name: 2-(phenylthio)adipic acid dimethyl ester Formula: C14H18O4S MolecularWeight: 282.35532

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(C(=O)OC)SC1=CC=CC=C1

Isomeric SMILES

COC(=O)CCCC(C(=O)OC)SC1=CC=CC=C1

InChI

InChI=1S/C14H18O4S/c1-17-13(15)10-6-9-12(14(16)18-2)19-11-7-4-3-5-8-11/h3-5,7-8,12H,6,9-10H2,1-2H3