N-methyl-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide

Systemtic Name: N-methyl-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Openeye Name: N-methyl-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide CAS Name: N-methyl-N-[[(3R)-1-methyl-3-piperidin-1-iumyl]methyl]-4-[(1-phenethyl-4-piperidin-1-iumyl)oxy]benzamide IUPAC Name: N-methyl-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxybenzamide Traditional Name: N-methyl-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Formula: C28H41N3O2+2 MolecularWeight: 451.64404

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC(C1)CN(C)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCC4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCC[C@@H](C1)CN(C)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C28H39N3O2/c1-29-17-6-9-24(21-29)22-30(2)28(32)25-10-12-26(13-11-25)33-27-15-19-31(20-16-27)18-14-23-7-4-3-5-8-23/h3-5,7-8,10-13,24,27H,6,9,14-22H2,1-2H3/p+2/t24-/m0/s1