3-oxidanyl-4-[[(4-pyridin-1-ium-2-ylpiperazin-1-yl)amino]methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 3-oxidanyl-4-[[(4-pyridin-1-ium-2-ylpiperazin-1-yl)amino]methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 3-hydroxy-4-[[(4-pyridin-1-ium-2-ylpiperazin-1-yl)amino]methylene]cyclohexa-2,5-dien-1-one CAS Name: 3-hydroxy-4-[[[4-(2-pyridin-1-iumyl)-1-piperazinyl]amino]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 3-hydroxy-4-[[(4-pyridin-1-ium-2-ylpiperazin-1-yl)amino]methylidene]cyclohexa-2,5-dien-1-one Traditional Name: 3-hydroxy-4-[[(4-pyridin-1-ium-2-ylpiperazino)amino]methylene]cyclohexa-2,5-dien-1-one Formula: C16H19N4O2+ MolecularWeight: 299.34766

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)NC=C3C=CC(=O)C=C3O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)NC=C3C=CC(=O)C=C3O

InChI

InChI=1S/C16H18N4O2/c21-14-5-4-13(15(22)11-14)12-18-20-9-7-19(8-10-20)16-3-1-2-6-17-16/h1-6,11-12,18,22H,7-10H2/p+1