2,5-dimethyl-3-(3-methylbutyl)-1-oxidanidyl-pyrazin-1-ium

Systemtic Name: 2,5-dimethyl-3-(3-methylbutyl)-1-oxidanidyl-pyrazin-1-ium Openeye Name: 3-isopentyl-2,5-dimethyl-1-oxido-pyrazin-1-ium CAS Name: 2,5-dimethyl-3-(3-methylbutyl)-1-oxidopyrazin-1-ium IUPAC Name: 2,5-dimethyl-3-(3-methylbutyl)-1-oxidopyrazin-1-ium Traditional Name: 3-isoamyl-2,5-dimethyl-1-oxido-pyrazin-1-ium Formula: C11H18N2O MolecularWeight: 194.27342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=C(C(=N1)CCC(C)C)C)[O-]

Isomeric SMILES

CC1=C[N+](=C(C(=N1)CCC(C)C)C)[O-]

InChI

InChI=1S/C11H18N2O/c1-8(2)5-6-11-10(4)13(14)7-9(3)12-11/h7-8H,5-6H2,1-4H3