tert-butyl (2S)-2-[(4S)-2-oxidanylidene-4-phenylmethoxycarbonyl-azetidin-1-yl]carbonylpyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[(4S)-2-oxidanylidene-4-phenylmethoxycarbonyl-azetidin-1-yl]carbonylpyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[(2S)-2-benzyloxycarbonyl-4-oxo-azetidine-1-carbonyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[oxo-[(4S)-2-oxo-4-phenylmethoxycarbonyl-1-azetidinyl]methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(4S)-2-oxo-4-phenylmethoxycarbonylazetidine-1-carbonyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[(2S)-2-carbobenzoxy-4-keto-azetidine-1-carbonyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C21H26N2O6 MolecularWeight: 402.44094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)N2C(CC2=O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N2[C@@H](CC2=O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O6/c1-21(2,3)29-20(27)22-11-7-10-15(22)18(25)23-16(12-17(23)24)19(26)28-13-14-8-5-4-6-9-14/h4-6,8-9,15-16H,7,10-13H2,1-3H3/t15-,16-/m0/s1