O1-tert-butyl O4-ethyl 2-(2-methylphenyl)sulfanylbutanedioate

Systemtic Name: O1-tert-butyl O4-ethyl 2-(2-methylphenyl)sulfanylbutanedioate Openeye Name: O1-tert-butyl O4-ethyl 2-(o-tolylsulfanyl)butanedioate CAS Name: 2-[(2-methylphenyl)thio]butanedioic acid O1-tert-butyl ester O4-ethyl ester IUPAC Name: 1-O-tert-butyl 4-O-ethyl 2-(2-methylphenyl)sulfanylbutanedioate Traditional Name: 2-(o-tolylthio)succinic acid O1-tert-butyl ester O4-ethyl ester Formula: C17H24O4S MolecularWeight: 324.43506

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C(=O)OC(C)(C)C)SC1=CC=CC=C1C

Isomeric SMILES

CCOC(=O)CC(C(=O)OC(C)(C)C)SC1=CC=CC=C1C

InChI

InChI=1S/C17H24O4S/c1-6-20-15(18)11-14(16(19)21-17(3,4)5)22-13-10-8-7-9-12(13)2/h7-10,14H,6,11H2,1-5H3