3-chloranyl-4-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-(oxan-4-ylmethyl)benzamide

Systemtic Name: 3-chloranyl-4-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-(oxan-4-ylmethyl)benzamide Openeye Name: 3-chloro-4-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-(tetrahydropyran-4-ylmethyl)benzamide CAS Name: 3-chloro-4-[[1-(2,2-dimethylpropyl)-4-piperidin-1-iumyl]oxy]-N-(4-oxanylmethyl)benzamide IUPAC Name: 3-chloro-4-[1-(2,2-dimethylpropyl)piperidin-1-ium-4-yl]oxy-N-(oxan-4-ylmethyl)benzamide Traditional Name: 3-chloro-4-(1-neopentylpiperidin-1-ium-4-yl)oxy-N-(tetrahydropyran-4-ylmethyl)benzamide Formula: C23H36ClN2O3+ MolecularWeight: 423.99654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C[NH+]1CCC(CC1)OC2=C(C=C(C=C2)C(=O)NCC3CCOCC3)Cl

Isomeric SMILES

CC(C)(C)C[NH+]1CCC(CC1)OC2=C(C=C(C=C2)C(=O)NCC3CCOCC3)Cl

InChI

InChI=1S/C23H35ClN2O3/c1-23(2,3)16-26-10-6-19(7-11-26)29-21-5-4-18(14-20(21)24)22(27)25-15-17-8-12-28-13-9-17/h4-5,14,17,19H,6-13,15-16H2,1-3H3,(H,25,27)/p+1