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

Systemtic Name: O1-methyl O3-[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-methyl O3-[2-oxo-2-[4-(1-piperidyl)anilino]ethyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[2-oxo-2-[4-(1-piperidinyl)anilino]ethyl] ester IUPAC Name: 1-O-methyl 3-O-[2-oxo-2-(4-piperidin-1-ylanilino)ethyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-keto-2-(4-piperidinoanilino)ethyl] ester O1-methyl ester Formula: C22H23N3O7 MolecularWeight: 441.43392

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C22H23N3O7/c1-31-21(27)15-11-16(13-19(12-15)25(29)30)22(28)32-14-20(26)23-17-5-7-18(8-6-17)24-9-3-2-4-10-24/h5-8,11-13H,2-4,9-10,14H2,1H3,(H,23,26)