(5-tert-butyl-2-methoxy-phenyl) thiocyanate

Systemtic Name: (5-tert-butyl-2-methoxy-phenyl) thiocyanate Openeye Name: (5-tert-butyl-2-methoxy-phenyl) thiocyanate CAS Name: thiocyanic acid (5-tert-butyl-2-methoxyphenyl) ester IUPAC Name: (5-tert-butyl-2-methoxyphenyl) thiocyanate Traditional Name: thiocyanic acid (5-tert-butyl-2-methoxy-phenyl) ester Formula: C12H15NOS MolecularWeight: 221.3186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)SC#N

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)SC#N

InChI

InChI=1S/C12H15NOS/c1-12(2,3)9-5-6-10(14-4)11(7-9)15-8-13/h5-7H,1-4H3