[2-(4-ethylphenyl)-2-oxidanylidene-ethyl] thiocyanate

Systemtic Name: [2-(4-ethylphenyl)-2-oxidanylidene-ethyl] thiocyanate Openeye Name: [2-(4-ethylphenyl)-2-oxo-ethyl] thiocyanate CAS Name: thiocyanic acid [2-(4-ethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-ethylphenyl)-2-oxoethyl] thiocyanate Traditional Name: thiocyanic acid [2-(4-ethylphenyl)-2-keto-ethyl] ester Formula: C11H11NOS MolecularWeight: 205.27614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)CSC#N

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)CSC#N

InChI

InChI=1S/C11H11NOS/c1-2-9-3-5-10(6-4-9)11(13)7-14-8-12/h3-6H,2,7H2,1H3