(1-phenoxy-3-thiocyanato-propan-2-yl)oxymethanedithioic acid

Systemtic Name: (1-phenoxy-3-thiocyanato-propan-2-yl)oxymethanedithioic acid Openeye Name: [1-(phenoxymethyl)-2-thiocyanato-ethoxy]methanedithioic acid CAS Name: (1-phenoxy-3-thiocyanatopropan-2-yl)oxymethanedithioic acid IUPAC Name: (1-phenoxy-3-thiocyanatopropan-2-yl)oxymethanedithioic acid Traditional Name: [1-(phenoxymethyl)-2-thiocyanato-ethoxy]methanedithioic acid Formula: C11H11NO2S3 MolecularWeight: 285.40554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(CSC#N)OC(=S)S

Isomeric SMILES

C1=CC=C(C=C1)OCC(CSC#N)OC(=S)S

InChI

InChI=1S/C11H11NO2S3/c12-8-17-7-10(14-11(15)16)6-13-9-4-2-1-3-5-9/h1-5,10H,6-7H2,(H,15,16)