1-[2-[(3-fluoranyl-4-methyl-phenyl)methylamino]-2-oxidanylidene-ethyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[(3-fluoranyl-4-methyl-phenyl)methylamino]-2-oxidanylidene-ethyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[(3-fluoro-4-methyl-phenyl)methylamino]-2-oxo-ethyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(3-fluoro-4-methylphenyl)methylamino]-2-oxoethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(3-fluoro-4-methylphenyl)methylamino]-2-oxoethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(3-fluoro-4-methyl-benzyl)amino]-2-keto-ethyl]proline Formula: C15H19FN2O3 MolecularWeight: 294.321363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)CN2CCCC2C(=O)O)F

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)CN2CCCC2C(=O)O)F

InChI

InChI=1S/C15H19FN2O3/c1-10-4-5-11(7-12(10)16)8-17-14(19)9-18-6-2-3-13(18)15(20)21/h4-5,7,13H,2-3,6,8-9H2,1H3,(H,17,19)(H,20,21)