N-methyl-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-N-(2-piperidin-1-ium-1-ylethyl)benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC[NH+]1CCCCC1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCC4=CC=CC=C4

Isomeric SMILES

CN(CC[NH+]1CCCCC1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C28H39N3O2/c1-29(22-23-30-17-6-3-7-18-30)28(32)25-10-12-26(13-11-25)33-27-15-20-31(21-16-27)19-14-24-8-4-2-5-9-24/h2,4-5,8-13,27H,3,6-7,14-23H2,1H3/p+2