(4-nitrophenyl)methyl 2-(3-chloranyl-2-oxidanylidene-azetidin-1-yl)-4,4-dimethyl-3-oxidanylidene-pentanoate

Systemtic Name: (4-nitrophenyl)methyl 2-(3-chloranyl-2-oxidanylidene-azetidin-1-yl)-4,4-dimethyl-3-oxidanylidene-pentanoate Openeye Name: (4-nitrophenyl)methyl 2-(3-chloro-2-oxo-azetidin-1-yl)-4,4-dimethyl-3-oxo-pentanoate CAS Name: 2-(3-chloro-2-oxo-1-azetidinyl)-4,4-dimethyl-3-oxopentanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(3-chloro-2-oxoazetidin-1-yl)-4,4-dimethyl-3-oxopentanoate Traditional Name: 2-(3-chloro-2-keto-azetidin-1-yl)-3-keto-4,4-dimethyl-valeric acid (4-nitrobenzyl) ester Formula: C17H19ClN2O6 MolecularWeight: 382.79556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])N2CC(C2=O)Cl

Isomeric SMILES

CC(C)(C)C(=O)C(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])N2CC(C2=O)Cl

InChI

InChI=1S/C17H19ClN2O6/c1-17(2,3)14(21)13(19-8-12(18)15(19)22)16(23)26-9-10-4-6-11(7-5-10)20(24)25/h4-7,12-13H,8-9H2,1-3H3