4-butylsulfanylbenzoic acid; sodium

Systemtic Name: 4-butylsulfanylbenzoic acid; sodium Openeye Name: 4-butylsulfanylbenzoic acid; sodium CAS Name: 4-(butylthio)benzoic acid; sodium IUPAC Name: 4-butylsulfanylbenzoic acid; sodium Traditional Name: 4-(butylthio)benzoic acid; sodium Formula: C11H14NaO2S MolecularWeight: 233.28243

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=C(C=C1)C(=O)O.[Na]

Isomeric SMILES

CCCCSC1=CC=C(C=C1)C(=O)O.[Na]

InChI

InChI=1S/C11H14O2S.Na/c1-2-3-8-14-10-6-4-9(5-7-10)11(12)13;/h4-7H,2-3,8H2,1H3,(H,12,13);