methyl 6-[(2S,3S,4S,5R,6R)-3-acetyloxy-5-azido-6-methyl-4-phenylmethoxy-oxan-2-yl]oxyhexanoate

Systemtic Name: methyl 6-[(2S,3S,4S,5R,6R)-3-acetyloxy-5-azido-6-methyl-4-phenylmethoxy-oxan-2-yl]oxyhexanoate Openeye Name: methyl 6-[(2S,3S,4S,5R,6R)-3-acetoxy-5-azido-4-benzyloxy-6-methyl-tetrahydropyran-2-yl]oxyhexanoate CAS Name: 6-[[(2S,3S,4S,5R,6R)-3-acetyloxy-5-azido-6-methyl-4-phenylmethoxy-2-oxanyl]oxy]hexanoic acid methyl ester IUPAC Name: methyl 6-[(2S,3S,4S,5R,6R)-3-acetyloxy-5-azido-6-methyl-4-phenylmethoxyoxan-2-yl]oxyhexanoate Traditional Name: 6-[(2S,3S,4S,5R,6R)-3-acetoxy-5-azido-4-benzoxy-6-methyl-tetrahydropyran-2-yl]oxyhexanoic acid methyl ester Formula: C22H31N3O7 MolecularWeight: 449.49744

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OCCCCCC(=O)OC)OC(=O)C)OCC2=CC=CC=C2)N=[N+]=[N-]

Isomeric SMILES

C[C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)OCCCCCC(=O)OC)OC(=O)C)OCC2=CC=CC=C2)N=[N+]=[N-]

InChI

InChI=1S/C22H31N3O7/c1-15-19(24-25-23)20(30-14-17-10-6-4-7-11-17)21(32-16(2)26)22(31-15)29-13-9-5-8-12-18(27)28-3/h4,6-7,10-11,15,19-22H,5,8-9,12-14H2,1-3H3/t15-,19-,20+,21+,22+/m1/s1