4-[2-(4-methylpiperidin-1-ium-1-yl)ethanoylamino]benzoate

Systemtic Name: 4-[2-(4-methylpiperidin-1-ium-1-yl)ethanoylamino]benzoate Openeye Name: 4-[[2-(4-methylpiperidin-1-ium-1-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(4-methyl-1-piperidin-1-iumyl)-1-oxoethyl]amino]benzoate IUPAC Name: 4-[[2-(4-methylpiperidin-1-ium-1-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(4-methylpiperidin-1-ium-1-yl)acetyl]amino]benzoate Formula: C15H20N2O3 MolecularWeight: 276.3309

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

CC1CC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C15H20N2O3/c1-11-6-8-17(9-7-11)10-14(18)16-13-4-2-12(3-5-13)15(19)20/h2-5,11H,6-10H2,1H3,(H,16,18)(H,19,20)