tert-butyl 2-nitro-2-[2,3,5-tris(chloranyl)phenyl]ethanoate

Systemtic Name: tert-butyl 2-nitro-2-[2,3,5-tris(chloranyl)phenyl]ethanoate Openeye Name: tert-butyl 2-nitro-2-(2,3,5-trichlorophenyl)acetate CAS Name: 2-nitro-2-(2,3,5-trichlorophenyl)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-nitro-2-(2,3,5-trichlorophenyl)acetate Traditional Name: 2-nitro-2-(2,3,5-trichlorophenyl)acetic acid tert-butyl ester Formula: C12H12Cl3NO4 MolecularWeight: 340.58698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C1=CC(=CC(=C1Cl)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)C(C1=CC(=CC(=C1Cl)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H12Cl3NO4/c1-12(2,3)20-11(17)10(16(18)19)7-4-6(13)5-8(14)9(7)15/h4-5,10H,1-3H3