(3S)-1-[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethyl]-2-oxidanylidene-pyrrolidine-3-carboxylic acid

Systemtic Name: (3S)-1-[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethyl]-2-oxidanylidene-pyrrolidine-3-carboxylic acid Openeye Name: (3S)-1-[2-(4-chloro-3,5-dimethyl-phenoxy)ethyl]-2-oxo-pyrrolidine-3-carboxylic acid CAS Name: (3S)-1-[2-(4-chloro-3,5-dimethylphenoxy)ethyl]-2-oxo-3-pyrrolidinecarboxylic acid IUPAC Name: (3S)-1-[2-(4-chloro-3,5-dimethylphenoxy)ethyl]-2-oxopyrrolidine-3-carboxylic acid Traditional Name: (3S)-1-[2-(4-chloro-3,5-dimethyl-phenoxy)ethyl]-2-keto-pyrrolidine-3-carboxylic acid Formula: C15H18ClNO4 MolecularWeight: 311.76072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCCN2CCC(C2=O)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCCN2CC[C@@H](C2=O)C(=O)O

InChI

InChI=1S/C15H18ClNO4/c1-9-7-11(8-10(2)13(9)16)21-6-5-17-4-3-12(14(17)18)15(19)20/h7-8,12H,3-6H2,1-2H3,(H,19,20)/t12-/m0/s1