3-[[methyl-(1-methylpiperidin-1-ium-4-yl)azaniumyl]methoxy]benzoate

Systemtic Name: 3-[[methyl-(1-methylpiperidin-1-ium-4-yl)azaniumyl]methoxy]benzoate Openeye Name: 3-[[methyl-(1-methylpiperidin-1-ium-4-yl)ammonio]methoxy]benzoate CAS Name: 3-[[methyl-(1-methyl-4-piperidin-1-iumyl)ammonio]methoxy]benzoate IUPAC Name: 3-[[methyl-(1-methylpiperidin-1-ium-4-yl)azaniumyl]methoxy]benzoate Traditional Name: 3-[[methyl-(1-methylpiperidin-1-ium-4-yl)ammonio]methoxy]benzoate Formula: C15H23N2O3+ MolecularWeight: 279.35472

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+](C)COC2=CC=CC(=C2)C(=O)[O-]

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+](C)COC2=CC=CC(=C2)C(=O)[O-]

InChI

InChI=1S/C15H22N2O3/c1-16-8-6-13(7-9-16)17(2)11-20-14-5-3-4-12(10-14)15(18)19/h3-5,10,13H,6-9,11H2,1-2H3,(H,18,19)/p+1