4-(1-phenethylpiperidin-1-ium-4-yl)oxy-N-(1-propylpiperidin-1-ium-4-yl)benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCC4=CC=CC=C4

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCC4=CC=CC=C4

InChI

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