[(2R,3R,4S,5S,6S)-4,5-diacetyloxy-6-[4,9-bis(oxidanylidene)benzo[f]benzotriazol-3-yl]-2-methyl-oxan-3-yl] ethanoate

Systemtic Name: [(2R,3R,4S,5S,6S)-4,5-diacetyloxy-6-[4,9-bis(oxidanylidene)benzo[f]benzotriazol-3-yl]-2-methyl-oxan-3-yl] ethanoate Openeye Name: [(2R,3R,4S,5S,6S)-4,5-diacetoxy-6-(4,9-dioxobenzo[f]benzotriazol-3-yl)-2-methyl-tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(2R,3R,4S,5S,6S)-4,5-diacetyloxy-6-(4,9-dioxo-3-benzo[f]benzotriazolyl)-2-methyl-3-oxanyl] ester IUPAC Name: [(2R,3R,4S,5S,6S)-4,5-diacetyloxy-6-(4,9-dioxobenzo[f]benzotriazol-3-yl)-2-methyloxan-3-yl] acetate Traditional Name: acetic acid [(2R,3R,4S,5S,6S)-4,5-diacetoxy-6-(4,9-diketobenzo[f]benzotriazol-3-yl)-2-methyl-tetrahydropyran-3-yl] ester Formula: C22H21N3O9 MolecularWeight: 471.41684

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)N2C3=C(C(=O)C4=CC=CC=C4C3=O)N=N2)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

C[C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)N2C3=C(C(=O)C4=CC=CC=C4C3=O)N=N2)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C22H21N3O9/c1-9-19(32-10(2)26)20(33-11(3)27)21(34-12(4)28)22(31-9)25-16-15(23-24-25)17(29)13-7-5-6-8-14(13)18(16)30/h5-9,19-22H,1-4H3/t9-,19-,20+,21+,22+/m1/s1