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

Systemtic Name: (3S)-1-[2-(4-chloranyl-2-methyl-phenoxy)ethyl]-2-oxidanylidene-pyrrolidine-3-carboxylic acid Openeye Name: (3S)-1-[2-(4-chloro-2-methyl-phenoxy)ethyl]-2-oxo-pyrrolidine-3-carboxylic acid CAS Name: (3S)-1-[2-(4-chloro-2-methylphenoxy)ethyl]-2-oxo-3-pyrrolidinecarboxylic acid IUPAC Name: (3S)-1-[2-(4-chloro-2-methylphenoxy)ethyl]-2-oxopyrrolidine-3-carboxylic acid Traditional Name: (3S)-1-[2-(4-chloro-2-methyl-phenoxy)ethyl]-2-keto-pyrrolidine-3-carboxylic acid Formula: C14H16ClNO4 MolecularWeight: 297.73414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCN2CCC(C2=O)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCN2CC[C@@H](C2=O)C(=O)O

InChI

InChI=1S/C14H16ClNO4/c1-9-8-10(15)2-3-12(9)20-7-6-16-5-4-11(13(16)17)14(18)19/h2-3,8,11H,4-7H2,1H3,(H,18,19)/t11-/m0/s1