2-[[(2,4-dichlorophenyl)carbonyl-(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]methyl]pyrrolidine-1-carboxylic acid

Systemtic Name: 2-[[(2,4-dichlorophenyl)carbonyl-(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]methyl]pyrrolidine-1-carboxylic acid Openeye Name: 2-[[(1-benzyl-2-hydroxy-2-oxo-ethyl)-(2,4-dichlorobenzoyl)amino]methyl]pyrrolidine-1-carboxylic acid CAS Name: 2-[[[(2,4-dichlorophenyl)-oxomethyl]-(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]methyl]-1-pyrrolidinecarboxylic acid IUPAC Name: 2-[[(2,4-dichlorobenzoyl)-(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]methyl]pyrrolidine-1-carboxylic acid Traditional Name: 2-[[(1-benzyl-2-hydroxy-2-keto-ethyl)-(2,4-dichlorobenzoyl)amino]methyl]pyrrolidine-1-carboxylic acid Formula: C22H22Cl2N2O5 MolecularWeight: 465.32648

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)O)CN(C(CC2=CC=CC=C2)C(=O)O)C(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CC(N(C1)C(=O)O)CN(C(CC2=CC=CC=C2)C(=O)O)C(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H22Cl2N2O5/c23-15-8-9-17(18(24)12-15)20(27)26(13-16-7-4-10-25(16)22(30)31)19(21(28)29)11-14-5-2-1-3-6-14/h1-3,5-6,8-9,12,16,19H,4,7,10-11,13H2,(H,28,29)(H,30,31)