(2R)-N-[(3-fluoranyl-4-methyl-phenyl)methyl]pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R)-N-[(3-fluoranyl-4-methyl-phenyl)methyl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R)-N-[(3-fluoro-4-methyl-phenyl)methyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2R)-N-[(3-fluoro-4-methylphenyl)methyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R)-N-[(3-fluoro-4-methylphenyl)methyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2R)-N-(3-fluoro-4-methyl-benzyl)pyrrolidin-1-ium-2-carboxamide Formula: C13H18FN2O+ MolecularWeight: 237.293223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)C2CCC[NH2+]2)F

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)[C@H]2CCC[NH2+]2)F

InChI

InChI=1S/C13H17FN2O/c1-9-4-5-10(7-11(9)14)8-16-13(17)12-3-2-6-15-12/h4-5,7,12,15H,2-3,6,8H2,1H3,(H,16,17)/p+1/t12-/m1/s1