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ethyl 2-[3-[(2-cyanocyclohexyl)methylsulfanyl]phenyl]propanoate

ethyl 2-[3-[(2-cyanocyclohexyl)methylsulfanyl]phenyl]propanoate

Systemtic Name:ethyl 2-[3-[(2-cyanocyclohexyl)methylsulfanyl]phenyl]propanoate
Openeye Name:ethyl 2-[3-[(2-cyanocyclohexyl)methylsulfanyl]phenyl]propanoate
CAS Name:2-[3-[(2-cyanocyclohexyl)methylthio]phenyl]propanoic acid ethyl ester
IUPAC Name:ethyl 2-[3-[(2-cyanocyclohexyl)methylsulfanyl]phenyl]propanoate
Traditional Name:2-[3-[(2-cyanocyclohexyl)methylthio]phenyl]propionic acid ethyl ester
Formula: C19H25NO2S
MolecularWeight: 331.4723
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)C1=CC(=CC=C1)SCC2CCCCC2C#N


Isomeric SMILES

CCOC(=O)C(C)C1=CC(=CC=C1)SCC2CCCCC2C#N


InChI

InChI=1S/C19H25NO2S/c1-3-22-19(21)14(2)15-9-6-10-18(11-15)23-13-17-8-5-4-7-16(17)12-20/h6,9-11,14,16-17H,3-5,7-8,13H2,1-2H3


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