[(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[3-(4-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]oxan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[3-(4-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]oxan-2-yl]methyl ethanoate Openeye Name: [(2R,3R,4S,5R,6R)-3,4,5-triacetoxy-6-[3-(4-methoxyphenyl)-6-oxo-pyridazin-1-yl]tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[3-(4-methoxyphenyl)-6-oxo-1-pyridazinyl]-2-oxanyl]methyl ester IUPAC Name: [(2R,3R,4S,5R,6R)-3,4,5-triacetyloxy-6-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]oxan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3R,4S,5R,6R)-3,4,5-triacetoxy-6-[6-keto-3-(4-methoxyphenyl)pyridazin-1-yl]tetrahydropyran-2-yl]methyl ester Formula: C25H28N2O11 MolecularWeight: 532.49662

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(C(O1)N2C(=O)C=CC(=N2)C3=CC=C(C=C3)OC)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)N2C(=O)C=CC(=N2)C3=CC=C(C=C3)OC)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C25H28N2O11/c1-13(28)34-12-20-22(35-14(2)29)23(36-15(3)30)24(37-16(4)31)25(38-20)27-21(32)11-10-19(26-27)17-6-8-18(33-5)9-7-17/h6-11,20,22-25H,12H2,1-5H3/t20-,22-,23+,24-,25-/m1/s1