1-[4-(4-chlorophenyl)-2-methyl-4-oxidanylidene-butanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[4-(4-chlorophenyl)-2-methyl-4-oxidanylidene-butanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[4-(4-chlorophenyl)-2-methyl-4-oxo-butanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[4-(4-chlorophenyl)-2-methyl-1,4-dioxobutyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-(4-chlorophenyl)-2-methyl-4-oxobutanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[4-(4-chlorophenyl)-4-keto-2-methyl-butanoyl]proline Formula: C16H18ClNO4 MolecularWeight: 323.77142

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C1=CC=C(C=C1)Cl)C(=O)N2CCCC2C(=O)O

Isomeric SMILES

CC(CC(=O)C1=CC=C(C=C1)Cl)C(=O)N2CCCC2C(=O)O

InChI

InChI=1S/C16H18ClNO4/c1-10(9-14(19)11-4-6-12(17)7-5-11)15(20)18-8-2-3-13(18)16(21)22/h4-7,10,13H,2-3,8-9H2,1H3,(H,21,22)