diethyl 2-(3-bromanyl-2-chloranyl-5-nitro-phenyl)carbonyl-2-methyl-propanedioate

Systemtic Name: diethyl 2-(3-bromanyl-2-chloranyl-5-nitro-phenyl)carbonyl-2-methyl-propanedioate Openeye Name: diethyl 2-(3-bromo-2-chloro-5-nitro-benzoyl)-2-methyl-propanedioate CAS Name: 2-[(3-bromo-2-chloro-5-nitrophenyl)-oxomethyl]-2-methylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-(3-bromo-2-chloro-5-nitrobenzoyl)-2-methylpropanedioate Traditional Name: 2-(3-bromo-2-chloro-5-nitro-benzoyl)-2-methyl-malonic acid diethyl ester Formula: C15H15BrClNO7 MolecularWeight: 436.6391

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C(=O)C1=CC(=CC(=C1Cl)Br)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C)(C(=O)C1=CC(=CC(=C1Cl)Br)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C15H15BrClNO7/c1-4-24-13(20)15(3,14(21)25-5-2)12(19)9-6-8(18(22)23)7-10(16)11(9)17/h6-7H,4-5H2,1-3H3