[(4aR,6R,7R,8S,8aS)-8-(2-chloranylethanoyloxy)-6-(9-methoxy-9-oxidanylidene-nonoxy)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate

Systemtic Name: [(4aR,6R,7R,8S,8aS)-8-(2-chloranylethanoyloxy)-6-(9-methoxy-9-oxidanylidene-nonoxy)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate Openeye Name: [(4aR,6R,7R,8S,8aS)-8-(2-chloroacetyl)oxy-6-(9-methoxy-9-oxo-nonoxy)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate CAS Name: benzoic acid [(4aR,6R,7R,8S,8aS)-8-(2-chloro-1-oxoethoxy)-6-(9-methoxy-9-oxononoxy)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] ester IUPAC Name: [(4aR,6R,7R,8S,8aS)-8-(2-chloroacetyl)oxy-6-(9-methoxy-9-oxononoxy)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] benzoate Traditional Name: benzoic acid [(4aR,6R,7R,8S,8aS)-8-(2-chloroacetyl)oxy-6-(9-keto-9-methoxy-nonoxy)-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl] ester Formula: C32H39ClO10 MolecularWeight: 619.09906

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCCOC1C(C(C2C(O1)COC(O2)C3=CC=CC=C3)OC(=O)CCl)OC(=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CCCCCCCCO[C@H]1[C@@H]([C@H]([C@@H]2[C@H](O1)COC(O2)C3=CC=CC=C3)OC(=O)CCl)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C32H39ClO10/c1-37-25(34)18-12-4-2-3-5-13-19-38-32-29(42-30(36)22-14-8-6-9-15-22)28(41-26(35)20-33)27-24(40-32)21-39-31(43-27)23-16-10-7-11-17-23/h6-11,14-17,24,27-29,31-32H,2-5,12-13,18-21H2,1H3/t24-,27+,28+,29-,31?,32-/m1/s1