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

Systemtic Name: 2-ethoxy-4-[[(4-methylpiperazin-4-ium-1-yl)amino]methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 2-ethoxy-4-[[(4-methylpiperazin-4-ium-1-yl)amino]methylene]cyclohexa-2,5-dien-1-one CAS Name: 2-ethoxy-4-[[(4-methyl-1-piperazin-4-iumyl)amino]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 2-ethoxy-4-[[(4-methylpiperazin-4-ium-1-yl)amino]methylidene]cyclohexa-2,5-dien-1-one Traditional Name: 2-ethoxy-4-[[(4-methylpiperazin-4-ium-1-yl)amino]methylene]cyclohexa-2,5-dien-1-one Formula: C14H22N3O2+ MolecularWeight: 264.34338

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNN2CC[NH+](CC2)C)C=CC1=O

Isomeric SMILES

CCOC1=CC(=CNN2CC[NH+](CC2)C)C=CC1=O

InChI

InChI=1S/C14H21N3O2/c1-3-19-14-10-12(4-5-13(14)18)11-15-17-8-6-16(2)7-9-17/h4-5,10-11,15H,3,6-9H2,1-2H3/p+1