5-cyano-2-[2-[[2-(2-hydroxyethylamino)phenyl]amino]-2-oxidanylidene-ethoxy]-2-phenoxy-pyrrolidine-1-carboxylic acid

Systemtic Name: 5-cyano-2-[2-[[2-(2-hydroxyethylamino)phenyl]amino]-2-oxidanylidene-ethoxy]-2-phenoxy-pyrrolidine-1-carboxylic acid Openeye Name: 5-cyano-2-[2-[2-(2-hydroxyethylamino)anilino]-2-oxo-ethoxy]-2-phenoxy-pyrrolidine-1-carboxylic acid CAS Name: 5-cyano-2-[2-[2-(2-hydroxyethylamino)anilino]-2-oxoethoxy]-2-phenoxy-1-pyrrolidinecarboxylic acid IUPAC Name: 5-cyano-2-[2-[2-(2-hydroxyethylamino)anilino]-2-oxoethoxy]-2-phenoxypyrrolidine-1-carboxylic acid Traditional Name: 5-cyano-2-[2-[2-(2-hydroxyethylamino)anilino]-2-keto-ethoxy]-2-phenoxy-pyrrolidine-1-carboxylic acid Formula: C22H24N4O6 MolecularWeight: 440.44916

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1C#N)C(=O)O)(OCC(=O)NC2=CC=CC=C2NCCO)OC3=CC=CC=C3

Isomeric SMILES

C1CC(N(C1C#N)C(=O)O)(OCC(=O)NC2=CC=CC=C2NCCO)OC3=CC=CC=C3

InChI

InChI=1S/C22H24N4O6/c23-14-16-10-11-22(26(16)21(29)30,32-17-6-2-1-3-7-17)31-15-20(28)25-19-9-5-4-8-18(19)24-12-13-27/h1-9,16,24,27H,10-13,15H2,(H,25,28)(H,29,30)