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4-(2-sulfanylphenyl)butanoate

4-(2-sulfanylphenyl)butanoate

Systemtic Name:4-(2-sulfanylphenyl)butanoate
Openeye Name:4-(2-sulfanylphenyl)butanoate
CAS Name:4-(2-mercaptophenyl)butanoate
IUPAC Name:4-(2-sulfanylphenyl)butanoate
Traditional Name:4-(2-mercaptophenyl)butyrate
Formula: C10H11O2S-
MolecularWeight: 195.25814
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCCC(=O)[O-])S


Isomeric SMILES

C1=CC=C(C(=C1)CCCC(=O)[O-])S


InChI

InChI=1S/C10H12O2S/c11-10(12)7-3-5-8-4-1-2-6-9(8)13/h1-2,4,6,13H,3,5,7H2,(H,11,12)/p-1


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