(3S)-1-(2-ethyl-6-methyl-phenyl)-2-oxidanylidene-pyrrolidine-3-carboxylic acid

Systemtic Name: (3S)-1-(2-ethyl-6-methyl-phenyl)-2-oxidanylidene-pyrrolidine-3-carboxylic acid Openeye Name: (3S)-1-(2-ethyl-6-methyl-phenyl)-2-oxo-pyrrolidine-3-carboxylic acid CAS Name: (3S)-1-(2-ethyl-6-methylphenyl)-2-oxo-3-pyrrolidinecarboxylic acid IUPAC Name: (3S)-1-(2-ethyl-6-methylphenyl)-2-oxopyrrolidine-3-carboxylic acid Traditional Name: (3S)-1-(2-ethyl-6-methyl-phenyl)-2-keto-pyrrolidine-3-carboxylic acid Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1N2CCC(C2=O)C(=O)O)C

Isomeric SMILES

CCC1=CC=CC(=C1N2CC[C@@H](C2=O)C(=O)O)C

InChI

InChI=1S/C14H17NO3/c1-3-10-6-4-5-9(2)12(10)15-8-7-11(13(15)16)14(17)18/h4-6,11H,3,7-8H2,1-2H3,(H,17,18)/t11-/m0/s1