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3-butan-2-ylsulfanylbenzoic acid

3-butan-2-ylsulfanylbenzoic acid

Systemtic Name:3-butan-2-ylsulfanylbenzoic acid
Openeye Name:3-sec-butylsulfanylbenzoic acid
CAS Name:3-(butan-2-ylthio)benzoic acid
IUPAC Name:3-butan-2-ylsulfanylbenzoic acid
Traditional Name:3-(sec-butylthio)benzoic acid
Formula: C11H14O2S
MolecularWeight: 210.29266
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=CC=CC(=C1)C(=O)O


Isomeric SMILES

CCC(C)SC1=CC=CC(=C1)C(=O)O


InChI

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


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