4-(4-methoxyphenoxy)but-2-ynyl thiocyanate

Systemtic Name: 4-(4-methoxyphenoxy)but-2-ynyl thiocyanate Openeye Name: 4-(4-methoxyphenoxy)but-2-ynyl thiocyanate CAS Name: thiocyanic acid 4-(4-methoxyphenoxy)but-2-ynyl ester IUPAC Name: 4-(4-methoxyphenoxy)but-2-ynyl thiocyanate Traditional Name: thiocyanic acid 4-(4-methoxyphenoxy)but-2-ynyl ester Formula: C12H11NO2S MolecularWeight: 233.28624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC#CCSC#N

Isomeric SMILES

COC1=CC=C(C=C1)OCC#CCSC#N

InChI

InChI=1S/C12H11NO2S/c1-14-11-4-6-12(7-5-11)15-8-2-3-9-16-10-13/h4-7H,8-9H2,1H3