[2-isothiocyanato-2-(4-methoxyphenyl)ethyl] thiocyanate

Systemtic Name: [2-isothiocyanato-2-(4-methoxyphenyl)ethyl] thiocyanate Openeye Name: [2-isothiocyanato-2-(4-methoxyphenyl)ethyl] thiocyanate CAS Name: thiocyanic acid [2-isothiocyanato-2-(4-methoxyphenyl)ethyl] ester IUPAC Name: [2-isothiocyanato-2-(4-methoxyphenyl)ethyl] thiocyanate Traditional Name: thiocyanic acid [2-isothiocyanato-2-(4-methoxyphenyl)ethyl] ester Formula: C11H10N2OS2 MolecularWeight: 250.3399

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CSC#N)N=C=S

Isomeric SMILES

COC1=CC=C(C=C1)C(CSC#N)N=C=S

InChI

InChI=1S/C11H10N2OS2/c1-14-10-4-2-9(3-5-10)11(13-8-15)6-16-7-12/h2-5,11H,6H2,1H3