2-[3-[2-(4-nitrophenyl)carbonyloxycarbonyloxypropan-2-yl]-4-oxidanylidene-azetidin-2-yl]ethanoic acid

Systemtic Name: 2-[3-[2-(4-nitrophenyl)carbonyloxycarbonyloxypropan-2-yl]-4-oxidanylidene-azetidin-2-yl]ethanoic acid Openeye Name: 2-[3-[1-methyl-1-(4-nitrobenzoyl)oxycarbonyloxy-ethyl]-4-oxo-azetidin-2-yl]acetic acid CAS Name: 2-[3-[2-[[(4-nitrophenyl)-oxomethoxy]-oxomethoxy]propan-2-yl]-4-oxo-2-azetidinyl]acetic acid IUPAC Name: 2-[3-[2-(4-nitrobenzoyl)oxycarbonyloxypropan-2-yl]-4-oxoazetidin-2-yl]acetic acid Traditional Name: 2-[4-keto-3-[1-methyl-1-(4-nitrobenzoyl)oxycarbonyloxy-ethyl]azetidin-2-yl]acetic acid Formula: C16H16N2O9 MolecularWeight: 380.30624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1C(NC1=O)CC(=O)O)OC(=O)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C1C(NC1=O)CC(=O)O)OC(=O)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O9/c1-16(2,12-10(7-11(19)20)17-13(12)21)27-15(23)26-14(22)8-3-5-9(6-4-8)18(24)25/h3-6,10,12H,7H2,1-2H3,(H,17,21)(H,19,20)