[(2R)-1-pyrrolidin-1-ium-1-ylpropan-2-yl] 2,4-bis(chloranyl)benzoate

Systemtic Name: [(2R)-1-pyrrolidin-1-ium-1-ylpropan-2-yl] 2,4-bis(chloranyl)benzoate Openeye Name: [(1R)-1-methyl-2-pyrrolidin-1-ium-1-yl-ethyl] 2,4-dichlorobenzoate CAS Name: 2,4-dichlorobenzoic acid [(2R)-1-(1-pyrrolidin-1-iumyl)propan-2-yl] ester IUPAC Name: [(2R)-1-pyrrolidin-1-ium-1-ylpropan-2-yl] 2,4-dichlorobenzoate Traditional Name: 2,4-dichlorobenzoic acid [(1R)-1-methyl-2-pyrrolidin-1-ium-1-yl-ethyl] ester Formula: C14H18Cl2NO2+ MolecularWeight: 303.20422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+]1CCCC1)OC(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C[C@H](C[NH+]1CCCC1)OC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C14H17Cl2NO2/c1-10(9-17-6-2-3-7-17)19-14(18)12-5-4-11(15)8-13(12)16/h4-5,8,10H,2-3,6-7,9H2,1H3/p+1/t10-/m1/s1