2-[2-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: 2-[2-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: 2-[[2-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: 2-[[2-[4-[2-(3,5-dimethoxyphenyl)ethyl]-1-piperidin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: 2-[[2-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: 2-[[2-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidin-1-ium-1-yl]acetyl]amino]benzamide Formula: C24H32N3O4+ MolecularWeight: 426.52858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CCC2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3C(=O)N)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CCC2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3C(=O)N)OC

InChI

InChI=1S/C24H31N3O4/c1-30-19-13-18(14-20(15-19)31-2)8-7-17-9-11-27(12-10-17)16-23(28)26-22-6-4-3-5-21(22)24(25)29/h3-6,13-15,17H,7-12,16H2,1-2H3,(H2,25,29)(H,26,28)/p+1