7-[3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-olate

Systemtic Name: 7-[3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-olate Openeye Name: 7-[3-acetamido-4,5-diacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]-1,1-dioxo-1,2-benzothiazol-3-olate CAS Name: 7-[3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)-2-oxanyl]-1,1-dioxo-1,2-benzothiazol-3-olate IUPAC Name: 7-[3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]-1,1-dioxo-1,2-benzothiazol-3-olate Traditional Name: 7-[3-acetamido-4,5-diacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]-1,1-diketo-1,2-benzothiazol-3-olate Formula: C21H23N2O11S- MolecularWeight: 511.47912

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C(C(OC1C2=CC=CC3=C2S(=O)(=O)N=C3[O-])COC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)NC1C(C(C(OC1C2=CC=CC3=C2S(=O)(=O)N=C3[O-])COC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C21H24N2O11S/c1-9(24)22-16-17(13-6-5-7-14-20(13)35(29,30)23-21(14)28)34-15(8-31-10(2)25)18(32-11(3)26)19(16)33-12(4)27/h5-7,15-19H,8H2,1-4H3,(H,22,24)(H,23,28)/p-1