4-[1-(1-adamantyl)piperidin-1-ium-4-yl]oxy-3-chloranyl-N-(2-methoxyethyl)benzamide

Systemtic Name: 4-[1-(1-adamantyl)piperidin-1-ium-4-yl]oxy-3-chloranyl-N-(2-methoxyethyl)benzamide Openeye Name: 4-[1-(1-adamantyl)piperidin-1-ium-4-yl]oxy-3-chloro-N-(2-methoxyethyl)benzamide CAS Name: 4-[[1-(1-adamantyl)-4-piperidin-1-iumyl]oxy]-3-chloro-N-(2-methoxyethyl)benzamide IUPAC Name: 4-[1-(1-adamantyl)piperidin-1-ium-4-yl]oxy-3-chloro-N-(2-methoxyethyl)benzamide Traditional Name: 4-[1-(1-adamantyl)piperidin-1-ium-4-yl]oxy-3-chloro-N-(2-methoxyethyl)benzamide Formula: C25H36ClN2O3+ MolecularWeight: 448.01794

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1=CC(=C(C=C1)OC2CC[NH+](CC2)C34CC5CC(C3)CC(C5)C4)Cl

Isomeric SMILES

COCCNC(=O)C1=CC(=C(C=C1)OC2CC[NH+](CC2)C34CC5CC(C3)CC(C5)C4)Cl

InChI

InChI=1S/C25H35ClN2O3/c1-30-9-6-27-24(29)20-2-3-23(22(26)13-20)31-21-4-7-28(8-5-21)25-14-17-10-18(15-25)12-19(11-17)16-25/h2-3,13,17-19,21H,4-12,14-16H2,1H3,(H,27,29)/p+1