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

Systemtic Name: tert-butyl 2-[3,5-bis(chloranyl)-2-nitro-phenyl]ethanoate Openeye Name: tert-butyl 2-(3,5-dichloro-2-nitro-phenyl)acetate CAS Name: 2-(3,5-dichloro-2-nitrophenyl)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(3,5-dichloro-2-nitrophenyl)acetate Traditional Name: 2-(3,5-dichloro-2-nitro-phenyl)acetic acid tert-butyl ester Formula: C12H13Cl2NO4 MolecularWeight: 306.14192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13Cl2NO4/c1-12(2,3)19-10(16)5-7-4-8(13)6-9(14)11(7)15(17)18/h4,6H,5H2,1-3H3