trideuteriomethyl 3,3-dideuterio-3-(4-nitrophenyl)propanoate

Systemtic Name: trideuteriomethyl 3,3-dideuterio-3-(4-nitrophenyl)propanoate Openeye Name: trideuteriomethyl 3,3-dideuterio-3-(4-nitrophenyl)propanoate CAS Name: 3,3-dideuterio-3-(4-nitrophenyl)propanoic acid trideuteriomethyl ester IUPAC Name: trideuteriomethyl 3,3-dideuterio-3-(4-nitrophenyl)propanoate Traditional Name: 3,3-dideuterio-3-(4-nitrophenyl)propionic acid trideuteriomethyl ester Formula: C10H11NO4 MolecularWeight: 214.229449

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

[2H]C([2H])([2H])OC(=O)CC([2H])([2H])C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C10H11NO4/c1-15-10(12)7-4-8-2-5-9(6-3-8)11(13)14/h2-3,5-6H,4,7H2,1H3/i1D3,4D2