ethyl 3-nitro-5-[[3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)phenyl]carbamoyl]benzoate

Systemtic Name: ethyl 3-nitro-5-[[3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)phenyl]carbamoyl]benzoate Openeye Name: ethyl 3-nitro-5-[[3-(2-oxo-2-pyrrolidin-1-yl-ethoxy)phenyl]carbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-[3-[2-oxo-2-(1-pyrrolidinyl)ethoxy]anilino]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-nitro-5-[[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]carbamoyl]benzoate Traditional Name: 3-[[3-(2-keto-2-pyrrolidino-ethoxy)phenyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C22H23N3O7 MolecularWeight: 441.43392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC(=CC=C2)OCC(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC(=CC=C2)OCC(=O)N3CCCC3)[N+](=O)[O-]

InChI

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