tert-butyl 4-[1-acetyloxy-2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-3-nitro-benzoate

Systemtic Name: tert-butyl 4-[1-acetyloxy-2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-3-nitro-benzoate Openeye Name: tert-butyl 4-(1-acetoxy-2-tert-butoxy-2-oxo-ethyl)-3-nitro-benzoate CAS Name: 4-[1-acetyloxy-2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-3-nitrobenzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-acetyloxy-2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-3-nitrobenzoate Traditional Name: 4-(1-acetoxy-2-tert-butoxy-2-keto-ethyl)-3-nitro-benzoic acid tert-butyl ester Formula: C19H25NO8 MolecularWeight: 395.4037

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25NO8/c1-11(21)26-15(17(23)28-19(5,6)7)13-9-8-12(10-14(13)20(24)25)16(22)27-18(2,3)4/h8-10,15H,1-7H3