2-[(5R,7R)-3-bromanyl-1-adamantyl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)ethanamide

Systemtic Name: 2-[(5R,7R)-3-bromanyl-1-adamantyl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)ethanamide Openeye Name: 2-[(5R,7R)-3-bromo-1-adamantyl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)acetamide CAS Name: 2-[(5R,7R)-3-bromo-1-adamantyl]-N-methyl-N-(1-methyl-4-piperidin-1-iumyl)acetamide IUPAC Name: 2-[(5R,7R)-3-bromo-1-adamantyl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)acetamide Traditional Name: 2-[(5R,7R)-3-bromo-1-adamantyl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)acetamide Formula: C19H32BrN2O+ MolecularWeight: 384.37418

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)C(=O)CC23CC4CC(C2)CC(C4)(C3)Br

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)C(=O)CC23C[C@H]4C[C@H](C2)CC(C4)(C3)Br

InChI

InChI=1S/C19H31BrN2O/c1-21-5-3-16(4-6-21)22(2)17(23)12-18-8-14-7-15(9-18)11-19(20,10-14)13-18/h14-16H,3-13H2,1-2H3/p+1/t14-,15-,18?,19?/m1/s1