(3-butyl-4-oxidanyl-phenyl) thiocyanate

Systemtic Name: (3-butyl-4-oxidanyl-phenyl) thiocyanate Openeye Name: (3-butyl-4-hydroxy-phenyl) thiocyanate CAS Name: thiocyanic acid (3-butyl-4-hydroxyphenyl) ester IUPAC Name: (3-butyl-4-hydroxyphenyl) thiocyanate Traditional Name: thiocyanic acid (3-butyl-4-hydroxy-phenyl) ester Formula: C11H13NOS MolecularWeight: 207.29202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1)SC#N)O

Isomeric SMILES

CCCCC1=C(C=CC(=C1)SC#N)O

InChI

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