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4-(3-propan-2-ylsulfanylpropoxy)benzoate

4-(3-propan-2-ylsulfanylpropoxy)benzoate

Systemtic Name:4-(3-propan-2-ylsulfanylpropoxy)benzoate
Openeye Name:4-(3-isopropylsulfanylpropoxy)benzoate
CAS Name:4-[3-(propan-2-ylthio)propoxy]benzoate
IUPAC Name:4-(3-propan-2-ylsulfanylpropoxy)benzoate
Traditional Name:4-[3-(isopropylthio)propoxy]benzoate
Formula: C13H17O3S-
MolecularWeight: 253.33728
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCCCOC1=CC=C(C=C1)C(=O)[O-]


Isomeric SMILES

CC(C)SCCCOC1=CC=C(C=C1)C(=O)[O-]


InChI

InChI=1S/C13H18O3S/c1-10(2)17-9-3-8-16-12-6-4-11(5-7-12)13(14)15/h4-7,10H,3,8-9H2,1-2H3,(H,14,15)/p-1


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