ditert-butyl 5-(trioxidanylsulfanyl)benzene-1,3-dicarboxylate

Systemtic Name: ditert-butyl 5-(trioxidanylsulfanyl)benzene-1,3-dicarboxylate Openeye Name: ditert-butyl 5-(trioxidanylsulfanyl)benzene-1,3-dicarboxylate CAS Name: 5-(trioxidanylthio)benzene-1,3-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 5-(trioxidanylsulfanyl)benzene-1,3-dicarboxylate Traditional Name: 5-(trioxidanylthio)benzene-1,3-dicarboxylic acid ditert-butyl ester Formula: C16H22O7S MolecularWeight: 358.40668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=CC(=C1)SOOO)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=CC(=C1)SOOO)C(=O)OC(C)(C)C

InChI

InChI=1S/C16H22O7S/c1-15(2,3)20-13(17)10-7-11(14(18)21-16(4,5)6)9-12(8-10)24-23-22-19/h7-9,19H,1-6H3