4-decylsulfanylbenzoic acid

Systemtic Name: 4-decylsulfanylbenzoic acid Openeye Name: 4-decylsulfanylbenzoic acid CAS Name: 4-(decylthio)benzoic acid IUPAC Name: 4-decylsulfanylbenzoic acid Traditional Name: 4-(decylthio)benzoic acid Formula: C17H26O2S MolecularWeight: 294.45214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CCCCCCCCCCSC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C17H26O2S/c1-2-3-4-5-6-7-8-9-14-20-16-12-10-15(11-13-16)17(18)19/h10-13H,2-9,14H2,1H3,(H,18,19)