[(2R)-1-pyrrolidin-1-ium-1-ylpropan-2-yl] 2-bromanylbenzoate

Systemtic Name: [(2R)-1-pyrrolidin-1-ium-1-ylpropan-2-yl] 2-bromanylbenzoate Openeye Name: [(1R)-1-methyl-2-pyrrolidin-1-ium-1-yl-ethyl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [(2R)-1-(1-pyrrolidin-1-iumyl)propan-2-yl] ester IUPAC Name: [(2R)-1-pyrrolidin-1-ium-1-ylpropan-2-yl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [(1R)-1-methyl-2-pyrrolidin-1-ium-1-yl-ethyl] ester Formula: C14H19BrNO2+ MolecularWeight: 313.21016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+]1CCCC1)OC(=O)C2=CC=CC=C2Br

Isomeric SMILES

C[C@H](C[NH+]1CCCC1)OC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C14H18BrNO2/c1-11(10-16-8-4-5-9-16)18-14(17)12-6-2-3-7-13(12)15/h2-3,6-7,11H,4-5,8-10H2,1H3/p+1/t11-/m1/s1