[(3S)-1-methylpiperidin-1-ium-3-yl] 3-methoxybenzoate

Systemtic Name: [(3S)-1-methylpiperidin-1-ium-3-yl] 3-methoxybenzoate Openeye Name: [(3S)-1-methylpiperidin-1-ium-3-yl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [(3S)-1-methyl-3-piperidin-1-iumyl] ester IUPAC Name: [(3S)-1-methylpiperidin-1-ium-3-yl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [(3S)-1-methylpiperidin-1-ium-3-yl] ester Formula: C14H20NO3+ MolecularWeight: 250.3135

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC(C1)OC(=O)C2=CC(=CC=C2)OC

Isomeric SMILES

C[NH+]1CCC[C@@H](C1)OC(=O)C2=CC(=CC=C2)OC

InChI

InChI=1S/C14H19NO3/c1-15-8-4-7-13(10-15)18-14(16)11-5-3-6-12(9-11)17-2/h3,5-6,9,13H,4,7-8,10H2,1-2H3/p+1/t13-/m0/s1