O1-ethyl O3-(2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl) 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-ethyl O3-(2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl) 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-ethyl O3-(2-oxo-1-phenyl-2-pyrrolidin-1-yl-ethyl) 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[2-oxo-1-phenyl-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: 1-O-ethyl 3-O-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl) 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-(2-keto-1-phenyl-2-pyrrolidino-ethyl) ester Formula: C22H22N2O7 MolecularWeight: 426.41928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC(C2=CC=CC=C2)C(=O)N3CCCC3

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC(C2=CC=CC=C2)C(=O)N3CCCC3

InChI

InChI=1S/C22H22N2O7/c1-2-30-21(26)16-12-17(14-18(13-16)24(28)29)22(27)31-19(15-8-4-3-5-9-15)20(25)23-10-6-7-11-23/h3-5,8-9,12-14,19H,2,6-7,10-11H2,1H3