(2-methyl-4-oxidanyl-5-propan-2-yl-phenyl) thiocyanate

Systemtic Name: (2-methyl-4-oxidanyl-5-propan-2-yl-phenyl) thiocyanate Openeye Name: (4-hydroxy-5-isopropyl-2-methyl-phenyl) thiocyanate CAS Name: thiocyanic acid (4-hydroxy-2-methyl-5-propan-2-ylphenyl) ester IUPAC Name: (4-hydroxy-2-methyl-5-propan-2-ylphenyl) thiocyanate Traditional Name: thiocyanic acid (4-hydroxy-5-isopropyl-2-methyl-phenyl) ester Formula: C11H13NOS MolecularWeight: 207.29202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1SC#N)C(C)C)O

Isomeric SMILES

CC1=CC(=C(C=C1SC#N)C(C)C)O

InChI

InChI=1S/C11H13NOS/c1-7(2)9-5-11(14-6-12)8(3)4-10(9)13/h4-5,7,13H,1-3H3