2,4,5-trimethoxy-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 2,4,5-trimethoxy-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 2,4,5-trimethoxy-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 2,4,5-trimethoxy-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 2,4,5-trimethoxy-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 2,4,5-trimethoxy-N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C23H31N2O4+ MolecularWeight: 399.50324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NCC2=CC=CC=C2C[NH+]3CCCCC3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NCC2=CC=CC=C2C[NH+]3CCCCC3)OC)OC

InChI

InChI=1S/C23H30N2O4/c1-27-20-14-22(29-3)21(28-2)13-19(20)23(26)24-15-17-9-5-6-10-18(17)16-25-11-7-4-8-12-25/h5-6,9-10,13-14H,4,7-8,11-12,15-16H2,1-3H3,(H,24,26)/p+1