[(4-methylphenyl)-nitro-methyl] 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(4-oxidanylideneazetidin-2-yl)oxy-ethanoate

Systemtic Name: [(4-methylphenyl)-nitro-methyl] 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(4-oxidanylideneazetidin-2-yl)oxy-ethanoate Openeye Name: [nitro(p-tolyl)methyl] 2-(tert-butoxycarbonylamino)-2-(4-oxoazetidin-2-yl)oxy-acetate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-[(4-oxo-2-azetidinyl)oxy]acetic acid [(4-methylphenyl)-nitromethyl] ester IUPAC Name: [(4-methylphenyl)-nitromethyl] 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(4-oxoazetidin-2-yl)oxyacetate Traditional Name: 2-(tert-butoxycarbonylamino)-2-(4-ketoazetidin-2-yl)oxy-acetic acid [nitro(p-tolyl)methyl] ester Formula: C18H23N3O8 MolecularWeight: 409.39052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C([N+](=O)[O-])OC(=O)C(NC(=O)OC(C)(C)C)OC2CC(=O)N2

Isomeric SMILES

CC1=CC=C(C=C1)C([N+](=O)[O-])OC(=O)C(NC(=O)OC(C)(C)C)OC2CC(=O)N2

InChI

InChI=1S/C18H23N3O8/c1-10-5-7-11(8-6-10)15(21(25)26)28-16(23)14(27-13-9-12(22)19-13)20-17(24)29-18(2,3)4/h5-8,13-15H,9H2,1-4H3,(H,19,22)(H,20,24)