tert-butyl 3-(4-chlorophenyl)-2-(hydroxymethyl)-5-oxidanylidene-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-(4-chlorophenyl)-2-(hydroxymethyl)-5-oxidanylidene-pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-(4-chlorophenyl)-2-(hydroxymethyl)-5-oxo-pyrrolidine-1-carboxylate CAS Name: 3-(4-chlorophenyl)-2-(hydroxymethyl)-5-oxo-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(4-chlorophenyl)-2-(hydroxymethyl)-5-oxopyrrolidine-1-carboxylate Traditional Name: 3-(4-chlorophenyl)-5-keto-2-methylol-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C16H20ClNO4 MolecularWeight: 325.7873

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(C(CC1=O)C2=CC=C(C=C2)Cl)CO

Isomeric SMILES

CC(C)(C)OC(=O)N1C(C(CC1=O)C2=CC=C(C=C2)Cl)CO

InChI

InChI=1S/C16H20ClNO4/c1-16(2,3)22-15(21)18-13(9-19)12(8-14(18)20)10-4-6-11(17)7-5-10/h4-7,12-13,19H,8-9H2,1-3H3