tert-butyl 2-[(1-acetamido-3-methyl-2-oxidanylidene-4-phenoxy-azetidin-3-yl)methyl]-1-azanyl-cyclohexane-1-carboxylate

Systemtic Name: tert-butyl 2-[(1-acetamido-3-methyl-2-oxidanylidene-4-phenoxy-azetidin-3-yl)methyl]-1-azanyl-cyclohexane-1-carboxylate Openeye Name: tert-butyl 2-[(1-acetamido-3-methyl-2-oxo-4-phenoxy-azetidin-3-yl)methyl]-1-amino-cyclohexanecarboxylate CAS Name: 2-[(1-acetamido-3-methyl-2-oxo-4-phenoxy-3-azetidinyl)methyl]-1-amino-1-cyclohexanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(1-acetamido-3-methyl-2-oxo-4-phenoxyazetidin-3-yl)methyl]-1-aminocyclohexane-1-carboxylate Traditional Name: 2-[(1-acetamido-2-keto-3-methyl-4-phenoxy-azetidin-3-yl)methyl]-1-amino-cyclohexanecarboxylic acid tert-butyl ester Formula: C24H35N3O5 MolecularWeight: 445.5518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NN1C(C(C1=O)(C)CC2CCCCC2(C(=O)OC(C)(C)C)N)OC3=CC=CC=C3

Isomeric SMILES

CC(=O)NN1C(C(C1=O)(C)CC2CCCCC2(C(=O)OC(C)(C)C)N)OC3=CC=CC=C3

InChI

InChI=1S/C24H35N3O5/c1-16(28)26-27-19(29)23(5,20(27)31-18-12-7-6-8-13-18)15-17-11-9-10-14-24(17,25)21(30)32-22(2,3)4/h6-8,12-13,17,20H,9-11,14-15,25H2,1-5H3,(H,26,28)