dimethyl (4R,5R)-2-(benzotriazol-1-ylmethyl)-1,2-oxazolidine-4,5-dicarboxylate

Systemtic Name: dimethyl (4R,5R)-2-(benzotriazol-1-ylmethyl)-1,2-oxazolidine-4,5-dicarboxylate Openeye Name: dimethyl (4R,5R)-2-(benzotriazol-1-ylmethyl)isoxazolidine-4,5-dicarboxylate CAS Name: (4R,5R)-2-(1-benzotriazolylmethyl)isoxazolidine-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (4R,5R)-2-(benzotriazol-1-ylmethyl)-1,2-oxazolidine-4,5-dicarboxylate Traditional Name: (4R,5R)-2-(benzotriazol-1-ylmethyl)isoxazolidine-4,5-dicarboxylic acid dimethyl ester Formula: C14H16N4O5 MolecularWeight: 320.30064

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(OC1C(=O)OC)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

COC(=O)[C@@H]1CN(O[C@H]1C(=O)OC)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C14H16N4O5/c1-21-13(19)9-7-17(23-12(9)14(20)22-2)8-18-11-6-4-3-5-10(11)15-16-18/h3-6,9,12H,7-8H2,1-2H3/t9-,12-/m1/s1