O1-ethyl O3-[2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)amino]ethyl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-ethyl O3-[2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)amino]ethyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-ethyl O3-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl] ester IUPAC Name: 1-O-ethyl 3-O-[2-oxo-2-(3,4,5-trimethoxyanilino)ethyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[2-keto-2-(3,4,5-trimethoxyanilino)ethyl] ester Formula: C21H22N2O10 MolecularWeight: 462.40678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)NC2=CC(=C(C(=C2)OC)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)NC2=CC(=C(C(=C2)OC)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H22N2O10/c1-5-32-20(25)12-6-13(8-15(7-12)23(27)28)21(26)33-11-18(24)22-14-9-16(29-2)19(31-4)17(10-14)30-3/h6-10H,5,11H2,1-4H3,(H,22,24)