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2-isothiocyanatopentanoate

2-isothiocyanatopentanoate

Systemtic Name:2-isothiocyanatopentanoate
Openeye Name:2-isothiocyanatopentanoate
CAS Name:2-isothiocyanatopentanoate
IUPAC Name:2-isothiocyanatopentanoate
Traditional Name:2-isothiocyanatovalerate
Formula: C6H8NO2S-
MolecularWeight: 158.19822
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)[O-])N=C=S


Isomeric SMILES

CCCC(C(=O)[O-])N=C=S


InChI

InChI=1S/C6H9NO2S/c1-2-3-5(6(8)9)7-4-10/h5H,2-3H2,1H3,(H,8,9)/p-1


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