2-methyl-N-[(E)-(2-methyl-3-oxidanyl-propylidyne)azaniumyldiazenyl]-3-oxidanyl-propanenitrilium

Systemtic Name: 2-methyl-N-[(E)-(2-methyl-3-oxidanyl-propylidyne)azaniumyldiazenyl]-3-oxidanyl-propanenitrilium Openeye Name: 3-hydroxy-N-[(E)-(3-hydroxy-2-methyl-propylidyne)ammonioazo]-2-methyl-propanenitrilium CAS Name: 3-hydroxy-N-[(E)-(3-hydroxy-2-methylpropylidyne)ammonioazo]-2-methylpropanenitrilium IUPAC Name: 3-hydroxy-N-[(E)-(3-hydroxy-2-methylpropylidyne)azaniumyldiazenyl]-2-methylpropanenitrilium Traditional Name: 3-hydroxy-N-[(E)-(3-hydroxy-2-methyl-propylidyne)ammonioazo]-2-methyl-propiononitrilium Formula: C8H14N4O2+2 MolecularWeight: 198.22236

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)C#[N+]N=N[N+]#CC(C)CO

Isomeric SMILES

CC(CO)C#[N+]/N=N/[N+]#CC(C)CO

InChI

InChI=1S/C8H14N4O2/c1-7(5-13)3-9-11-12-10-4-8(2)6-14/h7-8,13-14H,5-6H2,1-2H3/q+2/b12-11+