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

Systemtic Name: 2-ethoxy-4-[[(4-pyridin-1-ium-2-ylpiperazin-1-yl)amino]methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 2-ethoxy-4-[[(4-pyridin-1-ium-2-ylpiperazin-1-yl)amino]methylene]cyclohexa-2,5-dien-1-one CAS Name: 2-ethoxy-4-[[[4-(2-pyridin-1-iumyl)-1-piperazinyl]amino]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 2-ethoxy-4-[[(4-pyridin-1-ium-2-ylpiperazin-1-yl)amino]methylidene]cyclohexa-2,5-dien-1-one Traditional Name: 2-ethoxy-4-[[(4-pyridin-1-ium-2-ylpiperazino)amino]methylene]cyclohexa-2,5-dien-1-one Formula: C18H23N4O2+ MolecularWeight: 327.40082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNN2CCN(CC2)C3=CC=CC=[NH+]3)C=CC1=O

Isomeric SMILES

CCOC1=CC(=CNN2CCN(CC2)C3=CC=CC=[NH+]3)C=CC1=O

InChI

InChI=1S/C18H22N4O2/c1-2-24-17-13-15(6-7-16(17)23)14-20-22-11-9-21(10-12-22)18-5-3-4-8-19-18/h3-8,13-14,20H,2,9-12H2,1H3/p+1