1-[2-(2-hydroxyethyl)-3-methyl-4-oxidanylidene-azetidin-3-yl]ethyl 2-(4-nitrophenyl)ethaneperoxoate

Systemtic Name: 1-[2-(2-hydroxyethyl)-3-methyl-4-oxidanylidene-azetidin-3-yl]ethyl 2-(4-nitrophenyl)ethaneperoxoate Openeye Name: 1-[2-(2-hydroxyethyl)-3-methyl-4-oxo-azetidin-3-yl]ethyl 2-(4-nitrophenyl)peroxyacetate CAS Name: 2-(4-nitrophenyl)ethaneperoxoic acid 1-[2-(2-hydroxyethyl)-3-methyl-4-oxo-3-azetidinyl]ethyl ester IUPAC Name: 1-[2-(2-hydroxyethyl)-3-methyl-4-oxoazetidin-3-yl]ethyl 2-(4-nitrophenyl)ethaneperoxoate Traditional Name: 2-(4-nitrophenyl)peracetic acid 1-[2-(2-hydroxyethyl)-4-keto-3-methyl-azetidin-3-yl]ethyl ester Formula: C16H20N2O7 MolecularWeight: 352.3392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1(C(NC1=O)CCO)C)OOC(=O)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C1(C(NC1=O)CCO)C)OOC(=O)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H20N2O7/c1-10(16(2)13(7-8-19)17-15(16)21)24-25-14(20)9-11-3-5-12(6-4-11)18(22)23/h3-6,10,13,19H,7-9H2,1-2H3,(H,17,21)