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3-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-1-(methoxymethyl)-1-(3-methoxypropyl)-5-methyl-pyrazin-1-ium-2-one

3-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-1-(methoxymethyl)-1-(3-methoxypropyl)-5-methyl-pyrazin-1-ium-2-one

Systemtic Name:3-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-1-(methoxymethyl)-1-(3-methoxypropyl)-5-methyl-pyrazin-1-ium-2-one
Openeye Name:3-(4-bromo-2,6-dimethyl-anilino)-1-(methoxymethyl)-1-(3-methoxypropyl)-5-methyl-pyrazin-1-ium-2-one
CAS Name:3-(4-bromo-2,6-dimethylanilino)-1-(methoxymethyl)-1-(3-methoxypropyl)-5-methyl-2-pyrazin-1-iumone
IUPAC Name:3-(4-bromo-2,6-dimethylanilino)-1-(methoxymethyl)-1-(3-methoxypropyl)-5-methylpyrazin-1-ium-2-one
Traditional Name:3-(4-bromo-2,6-dimethyl-anilino)-1-(methoxymethyl)-1-(3-methoxypropyl)-5-methyl-pyrazin-1-ium-2-one
Formula: C19H27BrN3O3+
MolecularWeight: 425.33998
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC2=NC(=C[N+](C2=O)(CCCOC)COC)C)C)Br


Isomeric SMILES

CC1=CC(=CC(=C1NC2=NC(=C[N+](C2=O)(CCCOC)COC)C)C)Br


InChI

InChI=1S/C19H27BrN3O3/c1-13-9-16(20)10-14(2)17(13)22-18-19(24)23(12-26-5,7-6-8-25-4)11-15(3)21-18/h9-11H,6-8,12H2,1-5H3,(H,21,22)/q+1


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