tert-butyl 2-[2,3,5-tris(chloranyl)-6-nitro-phenyl]ethanoate

Systemtic Name: tert-butyl 2-[2,3,5-tris(chloranyl)-6-nitro-phenyl]ethanoate Openeye Name: tert-butyl 2-(2,3,5-trichloro-6-nitro-phenyl)acetate CAS Name: 2-(2,3,5-trichloro-6-nitrophenyl)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(2,3,5-trichloro-6-nitrophenyl)acetate Traditional Name: 2-(2,3,5-trichloro-6-nitro-phenyl)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)CC1=C(C(=CC(=C1Cl)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)CC1=C(C(=CC(=C1Cl)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H12Cl3NO4/c1-12(2,3)20-9(17)4-6-10(15)7(13)5-8(14)11(6)16(18)19/h5H,4H2,1-3H3