(2R)-1-[(2,4-dichlorophenyl)methyl]pyrrolidin-1-ium-2-carboxylate

Systemtic Name: (2R)-1-[(2,4-dichlorophenyl)methyl]pyrrolidin-1-ium-2-carboxylate Openeye Name: (2R)-1-[(2,4-dichlorophenyl)methyl]pyrrolidin-1-ium-2-carboxylate CAS Name: (2R)-1-[(2,4-dichlorophenyl)methyl]-2-pyrrolidin-1-iumcarboxylate IUPAC Name: (2R)-1-[(2,4-dichlorophenyl)methyl]pyrrolidin-1-ium-2-carboxylate Traditional Name: (2R)-1-(2,4-dichlorobenzyl)pyrrolidin-1-ium-2-carboxylate Formula: C12H13Cl2NO2 MolecularWeight: 274.14312

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=C(C=C(C=C2)Cl)Cl)C(=O)[O-]

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC2=C(C=C(C=C2)Cl)Cl)C(=O)[O-]

InChI

InChI=1S/C12H13Cl2NO2/c13-9-4-3-8(10(14)6-9)7-15-5-1-2-11(15)12(16)17/h3-4,6,11H,1-2,5,7H2,(H,16,17)/t11-/m1/s1