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

Systemtic Name: [(2R)-1-piperidin-1-ium-1-ylpropan-2-yl] 2,4-bis(chloranyl)benzoate Openeye Name: [(1R)-1-methyl-2-piperidin-1-ium-1-yl-ethyl] 2,4-dichlorobenzoate CAS Name: 2,4-dichlorobenzoic acid [(2R)-1-(1-piperidin-1-iumyl)propan-2-yl] ester IUPAC Name: [(2R)-1-piperidin-1-ium-1-ylpropan-2-yl] 2,4-dichlorobenzoate Traditional Name: 2,4-dichlorobenzoic acid [(1R)-1-methyl-2-piperidin-1-ium-1-yl-ethyl] ester Formula: C15H20Cl2NO2+ MolecularWeight: 317.2308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+]1CCCCC1)OC(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C[C@H](C[NH+]1CCCCC1)OC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C15H19Cl2NO2/c1-11(10-18-7-3-2-4-8-18)20-15(19)13-6-5-12(16)9-14(13)17/h5-6,9,11H,2-4,7-8,10H2,1H3/p+1/t11-/m1/s1