3,4-dimethoxy-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 3,4-dimethoxy-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3,4-dimethoxy-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 3,4-dimethoxy-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 3,4-dimethoxy-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3,4-dimethoxy-N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C22H29N2O3+ MolecularWeight: 369.47726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC2=CC=CC=C2C[NH+]3CCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC2=CC=CC=C2C[NH+]3CCCCC3)OC

InChI

InChI=1S/C22H28N2O3/c1-26-20-11-10-17(14-21(20)27-2)22(25)23-15-18-8-4-5-9-19(18)16-24-12-6-3-7-13-24/h4-5,8-11,14H,3,6-7,12-13,15-16H2,1-2H3,(H,23,25)/p+1