2-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]cinnolin-2-ium-4-olate

Systemtic Name: 2-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]cinnolin-2-ium-4-olate Openeye Name: 2-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]cinnolin-2-ium-4-olate CAS Name: 2-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-4-cinnolin-2-iumolate IUPAC Name: 2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]cinnolin-2-ium-4-olate Traditional Name: 2-[2-keto-2-(4-methylpiperazino)ethyl]cinnolin-2-ium-4-olate Formula: C15H18N4O2 MolecularWeight: 286.32902

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C[N+]2=NC3=CC=CC=C3C(=C2)[O-]

Isomeric SMILES

CN1CCN(CC1)C(=O)C[N+]2=NC3=CC=CC=C3C(=C2)[O-]

InChI

InChI=1S/C15H18N4O2/c1-17-6-8-18(9-7-17)15(21)11-19-10-14(20)12-4-2-3-5-13(12)16-19/h2-5,10H,6-9,11H2,1H3