(3,3-dimethyl-2,4-dihydro-1,5-benzodithiepin-7-yl) carbonochloridate

Systemtic Name: (3,3-dimethyl-2,4-dihydro-1,5-benzodithiepin-7-yl) carbonochloridate Openeye Name: (3,3-dimethyl-2,4-dihydro-1,5-benzodithiepin-7-yl) carbonochloridate CAS Name: carbonochloridic acid (3,3-dimethyl-2,4-dihydro-1,5-benzodithiepin-7-yl) ester IUPAC Name: (3,3-dimethyl-2,4-dihydro-1,5-benzodithiepin-7-yl) carbonochloridate Traditional Name: chlorocarbonic acid (3,3-dimethyl-2,4-dihydro-1,5-benzodithiepin-7-yl) ester Formula: C12H13ClO2S2 MolecularWeight: 288.81342

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CSC2=C(C=C(C=C2)OC(=O)Cl)SC1)C

Isomeric SMILES

CC1(CSC2=C(C=C(C=C2)OC(=O)Cl)SC1)C

InChI

InChI=1S/C12H13ClO2S2/c1-12(2)6-16-9-4-3-8(15-11(13)14)5-10(9)17-7-12/h3-5H,6-7H2,1-2H3