[(2R,3R,4S,5R,6R)-4,5-bis(4-azidobutanoyloxy)-2-(hydroxymethyl)-6-[(2S)-4-[(4-methoxyphenyl)methoxy]butan-2-yl]oxy-oxan-3-yl] 4-azidobutanoate

Systemtic Name: [(2R,3R,4S,5R,6R)-4,5-bis(4-azidobutanoyloxy)-2-(hydroxymethyl)-6-[(2S)-4-[(4-methoxyphenyl)methoxy]butan-2-yl]oxy-oxan-3-yl] 4-azidobutanoate Openeye Name: [(2R,3R,4S,5R,6R)-4,5-bis(4-azidobutanoyloxy)-2-(hydroxymethyl)-6-[(1S)-3-[(4-methoxyphenyl)methoxy]-1-methyl-propoxy]tetrahydropyran-3-yl] 4-azidobutanoate CAS Name: 4-azidobutanoic acid [(2R,3R,4S,5R,6R)-4,5-bis(4-azido-1-oxobutoxy)-2-(hydroxymethyl)-6-[(2S)-4-[(4-methoxyphenyl)methoxy]butan-2-yl]oxy-3-oxanyl] ester IUPAC Name: [(2R,3R,4S,5R,6R)-4,5-bis(4-azidobutanoyloxy)-2-(hydroxymethyl)-6-[(2S)-4-[(4-methoxyphenyl)methoxy]butan-2-yl]oxyoxan-3-yl] 4-azidobutanoate Traditional Name: 4-azidobutyric acid [(2R,3R,4S,5R,6R)-4,5-bis(4-azidobutanoyloxy)-2-methylol-6-[(1S)-1-methyl-3-p-anisyloxy-propoxy]tetrahydropyran-3-yl] ester Formula: C30H43N9O11 MolecularWeight: 705.71612

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOCC1=CC=C(C=C1)OC)OC2C(C(C(C(O2)CO)OC(=O)CCCN=[N+]=[N-])OC(=O)CCCN=[N+]=[N-])OC(=O)CCCN=[N+]=[N-]

Isomeric SMILES

C[C@@H](CCOCC1=CC=C(C=C1)OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)OC(=O)CCCN=[N+]=[N-])OC(=O)CCCN=[N+]=[N-])OC(=O)CCCN=[N+]=[N-]

InChI

InChI=1S/C30H43N9O11/c1-20(13-17-45-19-21-9-11-22(44-2)12-10-21)46-30-29(50-26(43)8-5-16-36-39-33)28(49-25(42)7-4-15-35-38-32)27(23(18-40)47-30)48-24(41)6-3-14-34-37-31/h9-12,20,23,27-30,40H,3-8,13-19H2,1-2H3/t20-,23+,27+,28-,29+,30+/m0/s1