2,4-dimethyl-2-(2-nitrophenyl)-3-oxidanylidene-pentanoic acid

Systemtic Name: 2,4-dimethyl-2-(2-nitrophenyl)-3-oxidanylidene-pentanoic acid Openeye Name: 2,4-dimethyl-2-(2-nitrophenyl)-3-oxo-pentanoic acid CAS Name: 2,4-dimethyl-2-(2-nitrophenyl)-3-oxopentanoic acid IUPAC Name: 2,4-dimethyl-2-(2-nitrophenyl)-3-oxopentanoic acid Traditional Name: 3-keto-2,4-dimethyl-2-(2-nitrophenyl)valeric acid Formula: C13H15NO5 MolecularWeight: 265.2619

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C(C)(C1=CC=CC=C1[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(C)C(=O)C(C)(C1=CC=CC=C1[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C13H15NO5/c1-8(2)11(15)13(3,12(16)17)9-6-4-5-7-10(9)14(18)19/h4-8H,1-3H3,(H,16,17)