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ethyl (3R)-3-isothiocyanatobutanoate

ethyl (3R)-3-isothiocyanatobutanoate

Systemtic Name:ethyl (3R)-3-isothiocyanatobutanoate
Openeye Name:ethyl (3R)-3-isothiocyanatobutanoate
CAS Name:(3R)-3-isothiocyanatobutanoic acid ethyl ester
IUPAC Name:ethyl (3R)-3-isothiocyanatobutanoate
Traditional Name:(3R)-3-isothiocyanatobutyric acid ethyl ester
Formula: C7H11NO2S
MolecularWeight: 173.23274
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)N=C=S


Isomeric SMILES

CCOC(=O)C[C@@H](C)N=C=S


InChI

InChI=1S/C7H11NO2S/c1-3-10-7(9)4-6(2)8-5-11/h6H,3-4H2,1-2H3/t6-/m1/s1


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