(2S)-1-[(2-chloranyl-4,6-dimethyl-phenyl)carbamoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(2-chloranyl-4,6-dimethyl-phenyl)carbamoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(2-chloro-4,6-dimethyl-phenyl)carbamoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(2-chloro-4,6-dimethylanilino)-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(2-chloro-4,6-dimethylphenyl)carbamoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(2-chloro-4,6-dimethyl-phenyl)carbamoyl]proline Formula: C14H17ClN2O3 MolecularWeight: 296.74938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=O)N2CCCC2C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=O)N2CCC[C@H]2C(=O)O)C

InChI

InChI=1S/C14H17ClN2O3/c1-8-6-9(2)12(10(15)7-8)16-14(20)17-5-3-4-11(17)13(18)19/h6-7,11H,3-5H2,1-2H3,(H,16,20)(H,18,19)/t11-/m0/s1