N-[(2R)-2-(5-methylfuran-2-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]adamantane-1-carboxamide

Systemtic Name: N-[(2R)-2-(5-methylfuran-2-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]adamantane-1-carboxamide Openeye Name: N-[(2R)-2-(5-methyl-2-furyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]adamantane-1-carboxamide CAS Name: N-[(2R)-2-(5-methyl-2-furanyl)-2-(4-methyl-1-piperidin-1-iumyl)ethyl]-1-adamantanecarboxamide IUPAC Name: N-[(2R)-2-(5-methylfuran-2-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]adamantane-1-carboxamide Traditional Name: N-[(2R)-2-(5-methyl-2-furyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]adamantane-1-carboxamide Formula: C24H37N2O2+ MolecularWeight: 385.56278

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(CNC(=O)C23CC4CC(C2)CC(C4)C3)C5=CC=C(O5)C

Isomeric SMILES

CC1CC[NH+](CC1)[C@H](CNC(=O)C23CC4CC(C2)CC(C4)C3)C5=CC=C(O5)C

InChI

InChI=1S/C24H36N2O2/c1-16-5-7-26(8-6-16)21(22-4-3-17(2)28-22)15-25-23(27)24-12-18-9-19(13-24)11-20(10-18)14-24/h3-4,16,18-21H,5-15H2,1-2H3,(H,25,27)/p+1/t18?,19?,20?,21-,24?/m1/s1