4-[[(4-methylpiperazin-4-ium-1-yl)amino]methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[(4-methylpiperazin-4-ium-1-yl)amino]methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[[(4-methylpiperazin-4-ium-1-yl)amino]methylene]cyclohexa-2,5-dien-1-one CAS Name: 4-[[(4-methyl-1-piperazin-4-iumyl)amino]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[(4-methylpiperazin-4-ium-1-yl)amino]methylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[[(4-methylpiperazin-4-ium-1-yl)amino]methylene]cyclohexa-2,5-dien-1-one Formula: C12H18N3O+ MolecularWeight: 220.29082

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC=C2C=CC(=O)C=C2

Isomeric SMILES

C[NH+]1CCN(CC1)NC=C2C=CC(=O)C=C2

InChI

InChI=1S/C12H17N3O/c1-14-6-8-15(9-7-14)13-10-11-2-4-12(16)5-3-11/h2-5,10,13H,6-9H2,1H3/p+1