2-[(2R,3S,4R)-5-acetyloxy-4-azido-3-phenylmethoxy-2-(phenylmethoxymethyl)oxolan-2-yl]ethyl 4-methylbenzoate

Systemtic Name: 2-[(2R,3S,4R)-5-acetyloxy-4-azido-3-phenylmethoxy-2-(phenylmethoxymethyl)oxolan-2-yl]ethyl 4-methylbenzoate Openeye Name: 2-[(2R,3S,4R)-5-acetoxy-4-azido-3-benzyloxy-2-(benzyloxymethyl)tetrahydrofuran-2-yl]ethyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid 2-[(2R,3S,4R)-5-acetyloxy-4-azido-3-phenylmethoxy-2-(phenylmethoxymethyl)-2-oxolanyl]ethyl ester IUPAC Name: 2-[(2R,3S,4R)-5-acetyloxy-4-azido-3-phenylmethoxy-2-(phenylmethoxymethyl)oxolan-2-yl]ethyl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid 2-[(2R,3S,4R)-5-acetoxy-4-azido-3-benzoxy-2-(benzoxymethyl)tetrahydrofuran-2-yl]ethyl ester Formula: C31H33N3O7 MolecularWeight: 559.60962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCCC2(C(C(C(O2)OC(=O)C)N=[N+]=[N-])OCC3=CC=CC=C3)COCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCC[C@]2([C@H]([C@H](C(O2)OC(=O)C)N=[N+]=[N-])OCC3=CC=CC=C3)COCC4=CC=CC=C4

InChI

InChI=1S/C31H33N3O7/c1-22-13-15-26(16-14-22)29(36)38-18-17-31(21-37-19-24-9-5-3-6-10-24)28(39-20-25-11-7-4-8-12-25)27(33-34-32)30(41-31)40-23(2)35/h3-16,27-28,30H,17-21H2,1-2H3/t27-,28+,30?,31-/m1/s1