[(2S,3R)-3-azido-2-(methoxymethoxy)-4-[(4-methoxyphenyl)methoxy]butyl] benzoate

Systemtic Name: [(2S,3R)-3-azido-2-(methoxymethoxy)-4-[(4-methoxyphenyl)methoxy]butyl] benzoate Openeye Name: [(2S,3R)-3-azido-2-(methoxymethoxy)-4-[(4-methoxyphenyl)methoxy]butyl] benzoate CAS Name: benzoic acid [(2S,3R)-3-azido-2-(methoxymethoxy)-4-[(4-methoxyphenyl)methoxy]butyl] ester IUPAC Name: [(2S,3R)-3-azido-2-(methoxymethoxy)-4-[(4-methoxyphenyl)methoxy]butyl] benzoate Traditional Name: benzoic acid [(2S,3R)-3-azido-2-(methoxymethoxy)-4-p-anisyloxy-butyl] ester Formula: C21H25N3O6 MolecularWeight: 415.4397

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Descriptors Computed from Structure

Canonical SMILES:

COCOC(COC(=O)C1=CC=CC=C1)C(COCC2=CC=C(C=C2)OC)N=[N+]=[N-]

Isomeric SMILES

COCO[C@H](COC(=O)C1=CC=CC=C1)[C@@H](COCC2=CC=C(C=C2)OC)N=[N+]=[N-]

InChI

InChI=1S/C21H25N3O6/c1-26-15-30-20(14-29-21(25)17-6-4-3-5-7-17)19(23-24-22)13-28-12-16-8-10-18(27-2)11-9-16/h3-11,19-20H,12-15H2,1-2H3/t19-,20-/m1/s1