[(2S,3R)-4-ethoxy-3-methyl-4-oxidanylidene-butan-2-yl] 4-nitrobenzoate

Systemtic Name: [(2S,3R)-4-ethoxy-3-methyl-4-oxidanylidene-butan-2-yl] 4-nitrobenzoate Openeye Name: [(1S,2R)-3-ethoxy-1,2-dimethyl-3-oxo-propyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(2S,3R)-4-ethoxy-3-methyl-4-oxobutan-2-yl] ester IUPAC Name: [(2S,3R)-4-ethoxy-3-methyl-4-oxobutan-2-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(1S,2R)-3-ethoxy-3-keto-1,2-dimethyl-propyl] ester Formula: C14H17NO6 MolecularWeight: 295.28788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO6/c1-4-20-13(16)9(2)10(3)21-14(17)11-5-7-12(8-6-11)15(18)19/h5-10H,4H2,1-3H3/t9-,10+/m1/s1