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

Systemtic Name: 4-[[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]amino]methylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[[4-(4-ethylpiperazin-4-ium-1-yl)anilino]methylene]-3-hydroxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[[4-(4-ethyl-1-piperazin-4-iumyl)anilino]methylidene]-3-hydroxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[4-(4-ethylpiperazin-4-ium-1-yl)anilino]methylidene]-3-hydroxycyclohexa-2,5-dien-1-one Traditional Name: 4-[[4-(4-ethylpiperazin-4-ium-1-yl)anilino]methylene]-3-hydroxy-cyclohexa-2,5-dien-1-one Formula: C19H24N3O2+ MolecularWeight: 326.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC=C3C=CC(=O)C=C3O

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC=C3C=CC(=O)C=C3O

InChI

InChI=1S/C19H23N3O2/c1-2-21-9-11-22(12-10-21)17-6-4-16(5-7-17)20-14-15-3-8-18(23)13-19(15)24/h3-8,13-14,20,24H,2,9-12H2,1H3/p+1