(1-methylpiperidin-1-ium-4-yl) 3-methoxybenzoate

Systemtic Name: (1-methylpiperidin-1-ium-4-yl) 3-methoxybenzoate Openeye Name: (1-methylpiperidin-1-ium-4-yl) 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid (1-methyl-4-piperidin-1-iumyl) ester IUPAC Name: (1-methylpiperidin-1-ium-4-yl) 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid (1-methylpiperidin-1-ium-4-yl) ester Formula: C14H20NO3+ MolecularWeight: 250.3135

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)OC(=O)C2=CC(=CC=C2)OC

Isomeric SMILES

C[NH+]1CCC(CC1)OC(=O)C2=CC(=CC=C2)OC

InChI

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