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

Systemtic Name: [2-(2-hydroxyethyl)-3-methyl-4-oxidanylidene-azetidin-3-yl]methyl 2-(4-nitrophenyl)ethaneperoxoate Openeye Name: [2-(2-hydroxyethyl)-3-methyl-4-oxo-azetidin-3-yl]methyl 2-(4-nitrophenyl)peroxyacetate CAS Name: 2-(4-nitrophenyl)ethaneperoxoic acid [2-(2-hydroxyethyl)-3-methyl-4-oxo-3-azetidinyl]methyl ester IUPAC Name: [2-(2-hydroxyethyl)-3-methyl-4-oxoazetidin-3-yl]methyl 2-(4-nitrophenyl)ethaneperoxoate Traditional Name: 2-(4-nitrophenyl)peracetic acid [2-(2-hydroxyethyl)-4-keto-3-methyl-azetidin-3-yl]methyl ester Formula: C15H18N2O7 MolecularWeight: 338.31262

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(NC1=O)CCO)COOC(=O)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1(C(NC1=O)CCO)COOC(=O)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O7/c1-15(12(6-7-18)16-14(15)20)9-23-24-13(19)8-10-2-4-11(5-3-10)17(21)22/h2-5,12,18H,6-9H2,1H3,(H,16,20)