[(2R)-1-pyrrolidin-1-ium-1-ylpropan-2-yl] 4-methoxybenzoate

Systemtic Name: [(2R)-1-pyrrolidin-1-ium-1-ylpropan-2-yl] 4-methoxybenzoate Openeye Name: [(1R)-1-methyl-2-pyrrolidin-1-ium-1-yl-ethyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [(2R)-1-(1-pyrrolidin-1-iumyl)propan-2-yl] ester IUPAC Name: [(2R)-1-pyrrolidin-1-ium-1-ylpropan-2-yl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [(1R)-1-methyl-2-pyrrolidin-1-ium-1-yl-ethyl] ester Formula: C15H22NO3+ MolecularWeight: 264.34008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO3/c1-12(11-16-9-3-4-10-16)19-15(17)13-5-7-14(18-2)8-6-13/h5-8,12H,3-4,9-11H2,1-2H3/p+1/t12-/m1/s1