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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CC(=O)N=C=S

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CC(=O)N=C=S

InChI

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