[2-phenyl-5-(thiocyanatomethyl)-1,3-dioxan-5-yl]methyl thiocyanate

Systemtic Name: [2-phenyl-5-(thiocyanatomethyl)-1,3-dioxan-5-yl]methyl thiocyanate Openeye Name: [2-phenyl-5-(thiocyanatomethyl)-1,3-dioxan-5-yl]methyl thiocyanate CAS Name: thiocyanic acid [2-phenyl-5-(thiocyanatomethyl)-1,3-dioxan-5-yl]methyl ester IUPAC Name: [2-phenyl-5-(thiocyanatomethyl)-1,3-dioxan-5-yl]methyl thiocyanate Traditional Name: thiocyanic acid [2-phenyl-5-(thiocyanatomethyl)-1,3-dioxan-5-yl]methyl ester Formula: C14H14N2O2S2 MolecularWeight: 306.40316

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC(O1)C2=CC=CC=C2)(CSC#N)CSC#N

Isomeric SMILES

C1C(COC(O1)C2=CC=CC=C2)(CSC#N)CSC#N

InChI

InChI=1S/C14H14N2O2S2/c15-10-19-8-14(9-20-11-16)6-17-13(18-7-14)12-4-2-1-3-5-12/h1-5,13H,6-9H2