4-(4-carboxysulfanylcarbonyloxydecoxy)benzoic acid

Systemtic Name: 4-(4-carboxysulfanylcarbonyloxydecoxy)benzoic acid Openeye Name: 4-(4-carboxysulfanylcarbonyloxydecoxy)benzoic acid CAS Name: 4-[4-[(carboxythio)-oxomethoxy]decoxy]benzoic acid IUPAC Name: 4-(4-carboxysulfanylcarbonyloxydecoxy)benzoic acid Traditional Name: 4-[4-(carboxythio)carbonyloxydecoxy]benzoic acid Formula: C19H26O7S MolecularWeight: 398.47054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCOC1=CC=C(C=C1)C(=O)O)OC(=O)SC(=O)O

Isomeric SMILES

CCCCCCC(CCCOC1=CC=C(C=C1)C(=O)O)OC(=O)SC(=O)O

InChI

InChI=1S/C19H26O7S/c1-2-3-4-5-7-16(26-19(24)27-18(22)23)8-6-13-25-15-11-9-14(10-12-15)17(20)21/h9-12,16H,2-8,13H2,1H3,(H,20,21)(H,22,23)