3-chloranyl-2,5-dimethyl-6-(3-methylbutyl)-1-oxidanidyl-pyrazin-1-ium

Systemtic Name: 3-chloranyl-2,5-dimethyl-6-(3-methylbutyl)-1-oxidanidyl-pyrazin-1-ium Openeye Name: 5-chloro-2-isopentyl-3,6-dimethyl-1-oxido-pyrazin-1-ium CAS Name: 3-chloro-2,5-dimethyl-6-(3-methylbutyl)-1-oxidopyrazin-1-ium IUPAC Name: 3-chloro-2,5-dimethyl-6-(3-methylbutyl)-1-oxidopyrazin-1-ium Traditional Name: 5-chloro-2-isoamyl-3,6-dimethyl-1-oxido-pyrazin-1-ium Formula: C11H17ClN2O MolecularWeight: 228.71848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H17ClN2O/c1-7(2)5-6-10-8(3)13-11(12)9(4)14(10)15/h7H,5-6H2,1-4H3