3-(5-methoxy-3-methyl-2-nitro-phenyl)-2-oxidanylidene-propanoic acid

Systemtic Name: 3-(5-methoxy-3-methyl-2-nitro-phenyl)-2-oxidanylidene-propanoic acid Openeye Name: 3-(5-methoxy-3-methyl-2-nitro-phenyl)-2-oxo-propanoic acid CAS Name: 3-(5-methoxy-3-methyl-2-nitrophenyl)-2-oxopropanoic acid IUPAC Name: 3-(5-methoxy-3-methyl-2-nitrophenyl)-2-oxopropanoic acid Traditional Name: 2-keto-3-(5-methoxy-3-methyl-2-nitro-phenyl)propionic acid Formula: C11H11NO6 MolecularWeight: 253.20814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1[N+](=O)[O-])CC(=O)C(=O)O)OC

Isomeric SMILES

CC1=CC(=CC(=C1[N+](=O)[O-])CC(=O)C(=O)O)OC

InChI

InChI=1S/C11H11NO6/c1-6-3-8(18-2)4-7(10(6)12(16)17)5-9(13)11(14)15/h3-4H,5H2,1-2H3,(H,14,15)