dimethyl (2R,6R)-2-(4-chlorophenyl)-4-oxidanylidene-1,3-diazinane-1,6-dicarboxylate

Systemtic Name: dimethyl (2R,6R)-2-(4-chlorophenyl)-4-oxidanylidene-1,3-diazinane-1,6-dicarboxylate Openeye Name: dimethyl (2R,6R)-2-(4-chlorophenyl)-4-oxo-hexahydropyrimidine-1,6-dicarboxylate CAS Name: (2R,6R)-2-(4-chlorophenyl)-4-oxo-1,3-diazinane-1,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2R,6R)-2-(4-chlorophenyl)-4-oxo-1,3-diazinane-1,6-dicarboxylate Traditional Name: (2R,6R)-2-(4-chlorophenyl)-4-keto-hexahydropyrimidine-1,6-dicarboxylic acid dimethyl ester Formula: C14H15ClN2O5 MolecularWeight: 326.7323

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(=O)NC(N1C(=O)OC)C2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)[C@H]1CC(=O)N[C@H](N1C(=O)OC)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H15ClN2O5/c1-21-13(19)10-7-11(18)16-12(17(10)14(20)22-2)8-3-5-9(15)6-4-8/h3-6,10,12H,7H2,1-2H3,(H,16,18)/t10-,12-/m1/s1