2-(3,5-dimethylphenoxy)ethyl thiocyanate

Systemtic Name: 2-(3,5-dimethylphenoxy)ethyl thiocyanate Openeye Name: 2-(3,5-dimethylphenoxy)ethyl thiocyanate CAS Name: thiocyanic acid 2-(3,5-dimethylphenoxy)ethyl ester IUPAC Name: 2-(3,5-dimethylphenoxy)ethyl thiocyanate Traditional Name: thiocyanic acid 2-(3,5-dimethylphenoxy)ethyl ester Formula: C11H13NOS MolecularWeight: 207.29202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCSC#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCSC#N)C

InChI

InChI=1S/C11H13NOS/c1-9-5-10(2)7-11(6-9)13-3-4-14-8-12/h5-7H,3-4H2,1-2H3