2-ethyl-1-[2-(1-methylpyrrolidin-1-ium-2-yl)ethyl]-3-oxidanyl-1H-pyridin-1-ium-4-one dibromide

Systemtic Name: 2-ethyl-1-[2-(1-methylpyrrolidin-1-ium-2-yl)ethyl]-3-oxidanyl-1H-pyridin-1-ium-4-one dibromide Openeye Name: 2-ethyl-3-hydroxy-1-[2-(1-methylpyrrolidin-1-ium-2-yl)ethyl]-1H-pyridin-1-ium-4-one dibromide CAS Name: 2-ethyl-3-hydroxy-1-[2-(1-methyl-2-pyrrolidin-1-iumyl)ethyl]-1H-pyridin-1-ium-4-one dibromide IUPAC Name: 2-ethyl-3-hydroxy-1-[2-(1-methylpyrrolidin-1-ium-2-yl)ethyl]-1H-pyridin-1-ium-4-one dibromide Traditional Name: 2-ethyl-3-hydroxy-1-[2-(1-methylpyrrolidin-1-ium-2-yl)ethyl]-1H-pyridin-1-ium-4-one dibromide Formula: C14H24Br2N2O2 MolecularWeight: 412.16056

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C=C[NH+]1CCC2CCC[NH+]2C)O.[Br-].[Br-]

Isomeric SMILES

CCC1=C(C(=O)C=C[NH+]1CCC2CCC[NH+]2C)O.[Br-].[Br-]

InChI

InChI=1S/C14H22N2O2.2BrH/c1-3-12-14(18)13(17)7-10-16(12)9-6-11-5-4-8-15(11)2;;/h7,10-11,18H,3-6,8-9H2,1-2H3;2*1H