N-[[(3R)-1-(1H-benzimidazol-2-ylmethyl)piperidin-1-ium-3-yl]methyl]-3,5-dimethoxy-benzamide

Systemtic Name: N-[[(3R)-1-(1H-benzimidazol-2-ylmethyl)piperidin-1-ium-3-yl]methyl]-3,5-dimethoxy-benzamide Openeye Name: N-[[(3R)-1-(1H-benzimidazol-2-ylmethyl)piperidin-1-ium-3-yl]methyl]-3,5-dimethoxy-benzamide CAS Name: N-[[(3R)-1-(1H-benzimidazol-2-ylmethyl)-3-piperidin-1-iumyl]methyl]-3,5-dimethoxybenzamide IUPAC Name: N-[[(3R)-1-(1H-benzimidazol-2-ylmethyl)piperidin-1-ium-3-yl]methyl]-3,5-dimethoxybenzamide Traditional Name: N-[[(3R)-1-(1H-benzimidazol-2-ylmethyl)piperidin-1-ium-3-yl]methyl]-3,5-dimethoxy-benzamide Formula: C23H29N4O3+ MolecularWeight: 409.50136

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NCC2CCC[NH+](C2)CC3=NC4=CC=CC=C4N3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NC[C@H]2CCC[NH+](C2)CC3=NC4=CC=CC=C4N3)OC

InChI

InChI=1S/C23H28N4O3/c1-29-18-10-17(11-19(12-18)30-2)23(28)24-13-16-6-5-9-27(14-16)15-22-25-20-7-3-4-8-21(20)26-22/h3-4,7-8,10-12,16H,5-6,9,13-15H2,1-2H3,(H,24,28)(H,25,26)/p+1/t16-/m1/s1