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

Systemtic Name: 4-[[methyl-(1-methylpiperidin-1-ium-4-yl)azaniumyl]methyl]benzoate Openeye Name: 4-[[methyl-(1-methylpiperidin-1-ium-4-yl)ammonio]methyl]benzoate CAS Name: 4-[[methyl-(1-methyl-4-piperidin-1-iumyl)ammonio]methyl]benzoate IUPAC Name: 4-[[methyl-(1-methylpiperidin-1-ium-4-yl)azaniumyl]methyl]benzoate Traditional Name: 4-[[methyl-(1-methylpiperidin-1-ium-4-yl)ammonio]methyl]benzoate Formula: C15H23N2O2+ MolecularWeight: 263.35532

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+](C)CC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+](C)CC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C15H22N2O2/c1-16-9-7-14(8-10-16)17(2)11-12-3-5-13(6-4-12)15(18)19/h3-6,14H,7-11H2,1-2H3,(H,18,19)/p+1