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

Systemtic Name: 4-[[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]amino]methylidene]-2-iodanyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[[4-(4-ethylpiperazin-4-ium-1-yl)anilino]methylene]-2-iodo-cyclohexa-2,5-dien-1-one CAS Name: 4-[[4-(4-ethyl-1-piperazin-4-iumyl)anilino]methylidene]-2-iodo-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[4-(4-ethylpiperazin-4-ium-1-yl)anilino]methylidene]-2-iodocyclohexa-2,5-dien-1-one Traditional Name: 4-[[4-(4-ethylpiperazin-4-ium-1-yl)anilino]methylene]-2-iodo-cyclohexa-2,5-dien-1-one Formula: C19H23IN3O+ MolecularWeight: 436.30989

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC=C3C=CC(=O)C(=C3)I

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC=C3C=CC(=O)C(=C3)I

InChI

InChI=1S/C19H22IN3O/c1-2-22-9-11-23(12-10-22)17-6-4-16(5-7-17)21-14-15-3-8-19(24)18(20)13-15/h3-8,13-14,21H,2,9-12H2,1H3/p+1