[2-(4-methoxyphenyl)-3-thiocyanato-propyl] thiocyanate

Systemtic Name: [2-(4-methoxyphenyl)-3-thiocyanato-propyl] thiocyanate Openeye Name: [2-(4-methoxyphenyl)-3-thiocyanato-propyl] thiocyanate CAS Name: thiocyanic acid [2-(4-methoxyphenyl)-3-thiocyanatopropyl] ester IUPAC Name: [2-(4-methoxyphenyl)-3-thiocyanatopropyl] thiocyanate Traditional Name: thiocyanic acid [2-(4-methoxyphenyl)-3-thiocyanato-propyl] ester Formula: C12H12N2OS2 MolecularWeight: 264.36648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2OS2/c1-15-12-4-2-10(3-5-12)11(6-16-8-13)7-17-9-14/h2-5,11H,6-7H2,1H3