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methyl 3-(2-cyanopropylsulfanyl)propanoate

methyl 3-(2-cyanopropylsulfanyl)propanoate

Systemtic Name:methyl 3-(2-cyanopropylsulfanyl)propanoate
Openeye Name:methyl 3-(2-cyanopropylsulfanyl)propanoate
CAS Name:3-(2-cyanopropylthio)propanoic acid methyl ester
IUPAC Name:methyl 3-(2-cyanopropylsulfanyl)propanoate
Traditional Name:3-(2-cyanopropylthio)propionic acid methyl ester
Formula: C8H13NO2S
MolecularWeight: 187.25932
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Descriptors Computed from Structure

Canonical SMILES:

CC(CSCCC(=O)OC)C#N


Isomeric SMILES

CC(CSCCC(=O)OC)C#N


InChI

InChI=1S/C8H13NO2S/c1-7(5-9)6-12-4-3-8(10)11-2/h7H,3-4,6H2,1-2H3


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