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

Systemtic Name: 2-[3-[2-[(4-nitrophenyl)methoxycarbonyloxy]propan-2-yl]-4-oxidanylidene-azetidin-2-yl]ethanoic acid Openeye Name: 2-[3-[1-methyl-1-[(4-nitrophenyl)methoxycarbonyloxy]ethyl]-4-oxo-azetidin-2-yl]acetic acid CAS Name: 2-[3-[2-[(4-nitrophenyl)methoxy-oxomethoxy]propan-2-yl]-4-oxo-2-azetidinyl]acetic acid IUPAC Name: 2-[3-[2-[(4-nitrophenyl)methoxycarbonyloxy]propan-2-yl]-4-oxoazetidin-2-yl]acetic acid Traditional Name: 2-[4-keto-3-[1-methyl-1-(4-nitrobenzyl)oxycarbonyloxy-ethyl]azetidin-2-yl]acetic acid Formula: C16H18N2O8 MolecularWeight: 366.32272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1C(NC1=O)CC(=O)O)OC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C1C(NC1=O)CC(=O)O)OC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O8/c1-16(2,13-11(7-12(19)20)17-14(13)21)26-15(22)25-8-9-3-5-10(6-4-9)18(23)24/h3-6,11,13H,7-8H2,1-2H3,(H,17,21)(H,19,20)