(3-hexylsulfanyl-2-methyl-propanoyl) 2-oxidanylbenzoate

Systemtic Name: (3-hexylsulfanyl-2-methyl-propanoyl) 2-oxidanylbenzoate Openeye Name: (3-hexylsulfanyl-2-methyl-propanoyl) 2-hydroxybenzoate CAS Name: 2-hydroxybenzoic acid [3-(hexylthio)-2-methyl-1-oxopropyl] ester IUPAC Name: (3-hexylsulfanyl-2-methylpropanoyl) 2-hydroxybenzoate Traditional Name: 2-hydroxybenzoic acid [3-(hexylthio)-2-methyl-propanoyl] ester Formula: C17H24O4S MolecularWeight: 324.43506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSCC(C)C(=O)OC(=O)C1=CC=CC=C1O

Isomeric SMILES

CCCCCCSCC(C)C(=O)OC(=O)C1=CC=CC=C1O

InChI

InChI=1S/C17H24O4S/c1-3-4-5-8-11-22-12-13(2)16(19)21-17(20)14-9-6-7-10-15(14)18/h6-7,9-10,13,18H,3-5,8,11-12H2,1-2H3