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methyl (2R)-2-isothiocyanatohexanoate

methyl (2R)-2-isothiocyanatohexanoate

Systemtic Name:methyl (2R)-2-isothiocyanatohexanoate
Openeye Name:methyl (2R)-2-isothiocyanatohexanoate
CAS Name:(2R)-2-isothiocyanatohexanoic acid methyl ester
IUPAC Name:methyl (2R)-2-isothiocyanatohexanoate
Traditional Name:(2R)-2-isothiocyanatohexanoic acid methyl ester
Formula: C8H13NO2S
MolecularWeight: 187.25932
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC)N=C=S


Isomeric SMILES

CCCC[C@H](C(=O)OC)N=C=S


InChI

InChI=1S/C8H13NO2S/c1-3-4-5-7(9-6-12)8(10)11-2/h7H,3-5H2,1-2H3/t7-/m1/s1


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