1-isothiocyanato-2-naphthalen-1-yl-ethanone

Systemtic Name: 1-isothiocyanato-2-naphthalen-1-yl-ethanone Openeye Name: 2-(1-naphthyl)acetyl isothiocyanate CAS Name: 1-isothiocyanato-2-(1-naphthalenyl)ethanone IUPAC Name: 2-naphthalen-1-ylacetyl isothiocyanate Traditional Name: 1-isothiocyanato-2-(1-naphthyl)ethanone Formula: C13H9NOS MolecularWeight: 227.28166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CC(=O)N=C=S

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CC(=O)N=C=S

InChI

InChI=1S/C13H9NOS/c15-13(14-9-16)8-11-6-3-5-10-4-1-2-7-12(10)11/h1-7H,8H2