4-[[2-(4-azanyl-1,2,4-triazol-3-yl)hydrazinyl]methylidene]-2-ethoxy-6-iodanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[2-(4-azanyl-1,2,4-triazol-3-yl)hydrazinyl]methylidene]-2-ethoxy-6-iodanyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[[2-(4-amino-1,2,4-triazol-3-yl)hydrazino]methylene]-2-ethoxy-6-iodo-cyclohexa-2,5-dien-1-one CAS Name: 4-[[(4-amino-1,2,4-triazol-3-yl)hydrazo]methylidene]-2-ethoxy-6-iodo-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[2-(4-amino-1,2,4-triazol-3-yl)hydrazinyl]methylidene]-2-ethoxy-6-iodocyclohexa-2,5-dien-1-one Traditional Name: 4-[[N'-(4-amino-1,2,4-triazol-3-yl)hydrazino]methylene]-2-ethoxy-6-iodo-cyclohexa-2,5-dien-1-one Formula: C11H13IN6O2 MolecularWeight: 388.16439

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNNC2=NN=CN2N)C=C(C1=O)I

Isomeric SMILES

CCOC1=CC(=CNNC2=NN=CN2N)C=C(C1=O)I

InChI

InChI=1S/C11H13IN6O2/c1-2-20-9-4-7(3-8(12)10(9)19)5-14-16-11-17-15-6-18(11)13/h3-6,14H,2,13H2,1H3,(H,16,17)