tert-butyl [8-chloranyl-6-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-methylsulfanyl-4-oxidanylidene-thiochromen-7-yl] carbonate

Systemtic Name: tert-butyl [8-chloranyl-6-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-methylsulfanyl-4-oxidanylidene-thiochromen-7-yl] carbonate Openeye Name: (6-tert-butoxycarbonyloxy-8-chloro-2-methylsulfanyl-4-oxo-thiochromen-7-yl) tert-butyl carbonate CAS Name: carbonic acid tert-butyl [8-chloro-6-[(2-methylpropan-2-yl)oxy-oxomethoxy]-2-(methylthio)-4-oxo-1-benzothiopyran-7-yl] ester IUPAC Name: tert-butyl [8-chloro-6-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-methylsulfanyl-4-oxothiochromen-7-yl] carbonate Traditional Name: carbonic acid [6-tert-butoxycarbonyloxy-8-chloro-4-keto-2-(methylthio)thiochromen-7-yl] tert-butyl ester Formula: C20H23ClO7S2 MolecularWeight: 474.97542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)OC1=C(C(=C2C(=C1)C(=O)C=C(S2)SC)Cl)OC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)OC1=C(C(=C2C(=C1)C(=O)C=C(S2)SC)Cl)OC(=O)OC(C)(C)C

InChI

InChI=1S/C20H23ClO7S2/c1-19(2,3)27-17(23)25-12-8-10-11(22)9-13(29-7)30-16(10)14(21)15(12)26-18(24)28-20(4,5)6/h8-9H,1-7H3