[(2R)-1-methoxy-1-oxidanylidene-propan-2-yl] 4-methyl-3-nitro-benzoate

Systemtic Name: [(2R)-1-methoxy-1-oxidanylidene-propan-2-yl] 4-methyl-3-nitro-benzoate Openeye Name: [(1R)-2-methoxy-1-methyl-2-oxo-ethyl] 4-methyl-3-nitro-benzoate CAS Name: 4-methyl-3-nitrobenzoic acid [(2R)-1-methoxy-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-methoxy-1-oxopropan-2-yl] 4-methyl-3-nitrobenzoate Traditional Name: 4-methyl-3-nitro-benzoic acid [(1R)-2-keto-2-methoxy-1-methyl-ethyl] ester Formula: C12H13NO6 MolecularWeight: 267.23472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO6/c1-7-4-5-9(6-10(7)13(16)17)12(15)19-8(2)11(14)18-3/h4-6,8H,1-3H3/t8-/m1/s1