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methyl 4-octylsulfanylcarbonylbenzoate

methyl 4-octylsulfanylcarbonylbenzoate

Systemtic Name:methyl 4-octylsulfanylcarbonylbenzoate
Openeye Name:methyl 4-octylsulfanylcarbonylbenzoate
CAS Name:4-[(octylthio)-oxomethyl]benzoic acid methyl ester
IUPAC Name:methyl 4-octylsulfanylcarbonylbenzoate
Traditional Name:4-(octylthio)carbonylbenzoic acid methyl ester
Formula: C17H24O3S
MolecularWeight: 308.43566
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC(=O)C1=CC=C(C=C1)C(=O)OC


Isomeric SMILES

CCCCCCCCSC(=O)C1=CC=C(C=C1)C(=O)OC


InChI

InChI=1S/C17H24O3S/c1-3-4-5-6-7-8-13-21-17(19)15-11-9-14(10-12-15)16(18)20-2/h9-12H,3-8,13H2,1-2H3


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