[(2R,3S,4R,5R,6R)-5-[1,3-bis(oxidanylidene)isoindol-2-yl]-6-pent-4-enoxy-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl] 2-(azidomethyl)benzoate

Systemtic Name: [(2R,3S,4R,5R,6R)-5-[1,3-bis(oxidanylidene)isoindol-2-yl]-6-pent-4-enoxy-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl] 2-(azidomethyl)benzoate Openeye Name: [(2R,3S,4R,5R,6R)-4-benzyloxy-2-(benzyloxymethyl)-5-(1,3-dioxoisoindolin-2-yl)-6-pent-4-enoxy-tetrahydropyran-3-yl] 2-(azidomethyl)benzoate CAS Name: 2-(azidomethyl)benzoic acid [(2R,3S,4R,5R,6R)-5-(1,3-dioxo-2-isoindolyl)-6-pent-4-enoxy-4-phenylmethoxy-2-(phenylmethoxymethyl)-3-oxanyl] ester IUPAC Name: [(2R,3S,4R,5R,6R)-5-(1,3-dioxoisoindol-2-yl)-6-pent-4-enoxy-4-phenylmethoxy-2-(phenylmethoxymethyl)oxan-3-yl] 2-(azidomethyl)benzoate Traditional Name: 2-(azidomethyl)benzoic acid [(2R,3S,4R,5R,6R)-4-benzoxy-2-(benzoxymethyl)-6-pent-4-enoxy-5-phthalimido-tetrahydropyran-3-yl] ester Formula: C41H40N4O8 MolecularWeight: 716.7783

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCOC1C(C(C(C(O1)COCC2=CC=CC=C2)OC(=O)C3=CC=CC=C3CN=[N+]=[N-])OCC4=CC=CC=C4)N5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

C=CCCCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COCC2=CC=CC=C2)OC(=O)C3=CC=CC=C3CN=[N+]=[N-])OCC4=CC=CC=C4)N5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C41H40N4O8/c1-2-3-14-23-50-41-35(45-38(46)32-21-12-13-22-33(32)39(45)47)37(51-26-29-17-8-5-9-18-29)36(34(52-41)27-49-25-28-15-6-4-7-16-28)53-40(48)31-20-11-10-19-30(31)24-43-44-42/h2,4-13,15-22,34-37,41H,1,3,14,23-27H2/t34-,35-,36-,37-,41-/m1/s1