3-[4-[2-azanyl-1-[5-cyano-2-(2-hydroxyethylamino)phenyl]-2-oxidanylidene-ethoxy]phenoxy]pyrrolidine-1-carboxylic acid

Systemtic Name: 3-[4-[2-azanyl-1-[5-cyano-2-(2-hydroxyethylamino)phenyl]-2-oxidanylidene-ethoxy]phenoxy]pyrrolidine-1-carboxylic acid Openeye Name: 3-[4-[2-amino-1-[5-cyano-2-(2-hydroxyethylamino)phenyl]-2-oxo-ethoxy]phenoxy]pyrrolidine-1-carboxylic acid CAS Name: 3-[4-[2-amino-1-[5-cyano-2-(2-hydroxyethylamino)phenyl]-2-oxoethoxy]phenoxy]-1-pyrrolidinecarboxylic acid IUPAC Name: 3-[4-[2-amino-1-[5-cyano-2-(2-hydroxyethylamino)phenyl]-2-oxoethoxy]phenoxy]pyrrolidine-1-carboxylic acid Traditional Name: 3-[4-[2-amino-1-[5-cyano-2-(2-hydroxyethylamino)phenyl]-2-keto-ethoxy]phenoxy]pyrrolidine-1-carboxylic acid Formula: C22H24N4O6 MolecularWeight: 440.44916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1OC2=CC=C(C=C2)OC(C3=C(C=CC(=C3)C#N)NCCO)C(=O)N)C(=O)O

Isomeric SMILES

C1CN(CC1OC2=CC=C(C=C2)OC(C3=C(C=CC(=C3)C#N)NCCO)C(=O)N)C(=O)O

InChI

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