1-isothiocyanato-2-(3-methoxyphenyl)ethanone

Systemtic Name: 1-isothiocyanato-2-(3-methoxyphenyl)ethanone Openeye Name: 2-(3-methoxyphenyl)acetyl isothiocyanate CAS Name: 1-isothiocyanato-2-(3-methoxyphenyl)ethanone IUPAC Name: 2-(3-methoxyphenyl)acetyl isothiocyanate Traditional Name: 1-isothiocyanato-2-(3-methoxyphenyl)ethanone Formula: C10H9NO2S MolecularWeight: 207.24896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC(=O)N=C=S

Isomeric SMILES

COC1=CC=CC(=C1)CC(=O)N=C=S

InChI

InChI=1S/C10H9NO2S/c1-13-9-4-2-3-8(5-9)6-10(12)11-7-14/h2-5H,6H2,1H3