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phenyl 2-isothiocyanatoethanoate

phenyl 2-isothiocyanatoethanoate

Systemtic Name:phenyl 2-isothiocyanatoethanoate
Openeye Name:phenyl 2-isothiocyanatoacetate
CAS Name:2-isothiocyanatoacetic acid phenyl ester
IUPAC Name:phenyl 2-isothiocyanatoacetate
Traditional Name:2-isothiocyanatoacetic acid phenyl ester
Formula: C9H7NO2S
MolecularWeight: 193.22238
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)CN=C=S


Isomeric SMILES

C1=CC=C(C=C1)OC(=O)CN=C=S


InChI

InChI=1S/C9H7NO2S/c11-9(6-10-7-13)12-8-4-2-1-3-5-8/h1-5H,6H2


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