tert-butyl 3-[(2-oxidanylidene-4-phenylmethoxycarbonyl-azetidin-3-yl)methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(2-oxidanylidene-4-phenylmethoxycarbonyl-azetidin-3-yl)methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[(2-benzyloxycarbonyl-4-oxo-azetidin-3-yl)methyl]piperidine-1-carboxylate CAS Name: 3-[(2-oxo-4-phenylmethoxycarbonyl-3-azetidinyl)methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(2-oxo-4-phenylmethoxycarbonylazetidin-3-yl)methyl]piperidine-1-carboxylate Traditional Name: 3-[(2-carbobenzoxy-4-keto-azetidin-3-yl)methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H30N2O5 MolecularWeight: 402.484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)CC2C(NC2=O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)CC2C(NC2=O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H30N2O5/c1-22(2,3)29-21(27)24-11-7-10-16(13-24)12-17-18(23-19(17)25)20(26)28-14-15-8-5-4-6-9-15/h4-6,8-9,16-18H,7,10-14H2,1-3H3,(H,23,25)