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4-nonan-3-ylsulfanylbenzoic acid

4-nonan-3-ylsulfanylbenzoic acid

Systemtic Name:4-nonan-3-ylsulfanylbenzoic acid
Openeye Name:4-(1-ethylheptylsulfanyl)benzoic acid
CAS Name:4-(nonan-3-ylthio)benzoic acid
IUPAC Name:4-nonan-3-ylsulfanylbenzoic acid
Traditional Name:4-(1-ethylheptylthio)benzoic acid
Formula: C16H24O2S
MolecularWeight: 280.42556
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C16H24O2S/c1-3-5-6-7-8-14(4-2)19-15-11-9-13(10-12-15)16(17)18/h9-12,14H,3-8H2,1-2H3,(H,17,18)


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