3-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-(3-pyridin-3-yloxypropyl)benzamide

Systemtic Name: 3-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-(3-pyridin-3-yloxypropyl)benzamide Openeye Name: 3-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-[3-(3-pyridyloxy)propyl]benzamide CAS Name: 3-[[1-(2,2-dimethylpropyl)-4-piperidin-1-iumyl]oxy]-N-[3-(3-pyridinyloxy)propyl]benzamide IUPAC Name: 3-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-(3-pyridin-3-yloxypropyl)benzamide Traditional Name: 3-(1-neopentylpiperidin-1-ium-4-yl)oxy-N-[3-(3-pyridyloxy)propyl]benzamide Formula: C25H36N3O3+ MolecularWeight: 426.57164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C[NH+]1CCC(CC1)OC2=CC=CC(=C2)C(=O)NCCCOC3=CN=CC=C3

Isomeric SMILES

CC(C)(C)C[NH+]1CCC(CC1)OC2=CC=CC(=C2)C(=O)NCCCOC3=CN=CC=C3

InChI

InChI=1S/C25H35N3O3/c1-25(2,3)19-28-14-10-21(11-15-28)31-22-8-4-7-20(17-22)24(29)27-13-6-16-30-23-9-5-12-26-18-23/h4-5,7-9,12,17-18,21H,6,10-11,13-16,19H2,1-3H3,(H,27,29)/p+1