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

Systemtic Name: methyl 4-[2-(4-methylpiperidin-1-ium-1-yl)ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(4-methylpiperidin-1-ium-1-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(4-methyl-1-piperidin-1-iumyl)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-methylpiperidin-1-ium-1-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(4-methylpiperidin-1-ium-1-yl)acetyl]amino]benzoic acid methyl ester Formula: C16H23N2O3+ MolecularWeight: 291.36542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O3/c1-12-7-9-18(10-8-12)11-15(19)17-14-5-3-13(4-6-14)16(20)21-2/h3-6,12H,7-11H2,1-2H3,(H,17,19)/p+1