(2R)-3-methoxy-2-methyl-2-(4-methyl-2-nitro-phenoxy)-3-oxidanylidene-propanoic acid

Systemtic Name: (2R)-3-methoxy-2-methyl-2-(4-methyl-2-nitro-phenoxy)-3-oxidanylidene-propanoic acid Openeye Name: (2R)-3-methoxy-2-methyl-2-(4-methyl-2-nitro-phenoxy)-3-oxo-propanoic acid CAS Name: (2R)-3-methoxy-2-methyl-2-(4-methyl-2-nitrophenoxy)-3-oxopropanoic acid IUPAC Name: (2R)-3-methoxy-2-methyl-2-(4-methyl-2-nitrophenoxy)-3-oxopropanoic acid Traditional Name: (2R)-3-keto-3-methoxy-2-methyl-2-(4-methyl-2-nitro-phenoxy)propionic acid Formula: C12H13NO7 MolecularWeight: 283.23412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO7/c1-7-4-5-9(8(6-7)13(17)18)20-12(2,10(14)15)11(16)19-3/h4-6H,1-3H3,(H,14,15)/t12-/m1/s1