O1-methyl O3-[2-oxidanylidene-2-[phenethyl-(phenylmethyl)amino]ethyl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-[2-oxidanylidene-2-[phenethyl-(phenylmethyl)amino]ethyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-[benzyl(phenethyl)amino]-2-oxo-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-[2-oxo-2-[phenethyl-(phenylmethyl)amino]ethyl] ester IUPAC Name: 3-O-[2-[benzyl(phenethyl)amino]-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-[benzyl(phenethyl)amino]-2-keto-ethyl] ester O1-methyl ester Formula: C26H24N2O7 MolecularWeight: 476.47796

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C26H24N2O7/c1-34-25(30)21-14-22(16-23(15-21)28(32)33)26(31)35-18-24(29)27(17-20-10-6-3-7-11-20)13-12-19-8-4-2-5-9-19/h2-11,14-16H,12-13,17-18H2,1H3