(2S)-1-(4-ethylphenyl)carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-(4-ethylphenyl)carbonylpyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-(4-ethylbenzoyl)pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(4-ethylphenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-(4-ethylbenzoyl)pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-(4-ethylbenzoyl)proline Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCCC2C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCC[C@H]2C(=O)O

InChI

InChI=1S/C14H17NO3/c1-2-10-5-7-11(8-6-10)13(16)15-9-3-4-12(15)14(17)18/h5-8,12H,2-4,9H2,1H3,(H,17,18)/t12-/m0/s1