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

Systemtic Name: propan-2-yl 4-[2-(4-methylpiperidin-1-ium-1-yl)ethanoylamino]benzoate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 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 isopropyl ester Formula: C18H27N2O3+ MolecularWeight: 319.41858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O3/c1-13(2)23-18(22)15-4-6-16(7-5-15)19-17(21)12-20-10-8-14(3)9-11-20/h4-7,13-14H,8-12H2,1-3H3,(H,19,21)/p+1