O1-diphenylphosphinothioyl O2,O4-dimethyl (2R,4R)-azetidine-1,2,4-tricarboxylate

Systemtic Name: O1-diphenylphosphinothioyl O2,O4-dimethyl (2R,4R)-azetidine-1,2,4-tricarboxylate Openeye Name: O1-diphenylphosphinothioyl O2,O4-dimethyl (2R,4R)-azetidine-1,2,4-tricarboxylate CAS Name: (2R,4R)-azetidine-1,2,4-tricarboxylic acid O1-diphenylphosphinothioyl ester O2,O4-dimethyl ester IUPAC Name: 1-O-diphenylphosphinothioyl 2-O,4-O-dimethyl (2R,4R)-azetidine-1,2,4-tricarboxylate Traditional Name: (2R,4R)-azetidine-1,2,4-tricarboxylic acid O1-diphenylthiophosphoryl ester O2,O4-dimethyl ester Formula: C20H20NO6PS MolecularWeight: 433.414661

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(N1C(=O)OP(=S)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)[C@H]1C[C@@H](N1C(=O)OP(=S)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C20H20NO6PS/c1-25-18(22)16-13-17(19(23)26-2)21(16)20(24)27-28(29,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12,16-17H,13H2,1-2H3/t16-,17-/m1/s1