tert-butyl 4-[[3,4-bis(chloranyl)phenoxy]carbonylamino]-5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxylate

Systemtic Name: tert-butyl 4-[[3,4-bis(chloranyl)phenoxy]carbonylamino]-5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxylate Openeye Name: tert-butyl 4-[(3,4-dichlorophenoxy)carbonylamino]-5-oxo-1-phenyl-pyrrolidine-3-carboxylate CAS Name: 4-[[(3,4-dichlorophenoxy)-oxomethyl]amino]-5-oxo-1-phenyl-3-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(3,4-dichlorophenoxy)carbonylamino]-5-oxo-1-phenylpyrrolidine-3-carboxylate Traditional Name: 4-[(3,4-dichlorophenoxy)carbonylamino]-5-keto-1-phenyl-pyrrolidine-3-carboxylic acid tert-butyl ester Formula: C22H22Cl2N2O5 MolecularWeight: 465.32648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CN(C(=O)C1NC(=O)OC2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)C1CN(C(=O)C1NC(=O)OC2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3

InChI

InChI=1S/C22H22Cl2N2O5/c1-22(2,3)31-20(28)15-12-26(13-7-5-4-6-8-13)19(27)18(15)25-21(29)30-14-9-10-16(23)17(24)11-14/h4-11,15,18H,12H2,1-3H3,(H,25,29)