O1-methyl O3-[2-oxidanylidene-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-[2-oxidanylidene-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-methyl O3-[2-oxo-2-(1,1,3,3-tetramethylbutylamino)ethyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] ester IUPAC Name: 1-O-methyl 3-O-[2-oxo-2-(2,4,4-trimethylpentan-2-ylamino)ethyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-keto-2-(1,1,3,3-tetramethylbutylamino)ethyl] ester O1-methyl ester Formula: C19H26N2O7 MolecularWeight: 394.41894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O7/c1-18(2,3)11-19(4,5)20-15(22)10-28-17(24)13-7-12(16(23)27-6)8-14(9-13)21(25)26/h7-9H,10-11H2,1-6H3,(H,20,22)