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

Systemtic Name: 6-chloranyl-2-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]cinnolin-2-ium-4-olate Openeye Name: 6-chloro-2-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]cinnolin-2-ium-4-olate CAS Name: 6-chloro-2-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-4-cinnolin-2-iumolate IUPAC Name: 6-chloro-2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]cinnolin-2-ium-4-olate Traditional Name: 6-chloro-2-[2-keto-2-(4-methylpiperazino)ethyl]cinnolin-2-ium-4-olate Formula: C15H17ClN4O2 MolecularWeight: 320.77408

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C[N+]2=NC3=C(C=C(C=C3)Cl)C(=C2)[O-]

Isomeric SMILES

CN1CCN(CC1)C(=O)C[N+]2=NC3=C(C=C(C=C3)Cl)C(=C2)[O-]

InChI

InChI=1S/C15H17ClN4O2/c1-18-4-6-19(7-5-18)15(22)10-20-9-14(21)12-8-11(16)2-3-13(12)17-20/h2-3,8-9H,4-7,10H2,1H3