O3-[2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(tert-butylcarbamoylamino)-2-oxo-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-[[(tert-butylamino)-oxomethyl]amino]-2-oxoethyl] ester O1-methyl ester IUPAC Name: 3-O-[2-(tert-butylcarbamoylamino)-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(tert-butylcarbamoylamino)-2-keto-ethyl] ester O1-methyl ester Formula: C16H19N3O8 MolecularWeight: 381.33736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O8/c1-16(2,3)18-15(23)17-12(20)8-27-14(22)10-5-9(13(21)26-4)6-11(7-10)19(24)25/h5-7H,8H2,1-4H3,(H2,17,18,20,23)