5-bromanyl-1-[[4-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-1-yl]methyl]pyridin-2-one

Systemtic Name: 5-bromanyl-1-[[4-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-1-yl]methyl]pyridin-2-one Openeye Name: 5-bromo-1-[[4-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-1-yl]methyl]pyridin-2-one CAS Name: 5-bromo-1-[[4-[2-(4-methoxyphenyl)ethyl]-1-piperidin-1-iumyl]methyl]-2-pyridinone IUPAC Name: 5-bromo-1-[[4-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-1-yl]methyl]pyridin-2-one Traditional Name: 5-bromo-1-[[4-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-1-yl]methyl]-2-pyridone Formula: C20H26BrN2O2+ MolecularWeight: 406.33664

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC2CC[NH+](CC2)CN3C=C(C=CC3=O)Br

Isomeric SMILES

COC1=CC=C(C=C1)CCC2CC[NH+](CC2)CN3C=C(C=CC3=O)Br

InChI

InChI=1S/C20H25BrN2O2/c1-25-19-7-4-16(5-8-19)2-3-17-10-12-22(13-11-17)15-23-14-18(21)6-9-20(23)24/h4-9,14,17H,2-3,10-13,15H2,1H3/p+1