4-[[(5-azanyl-1,2,3,4-tetrazol-1-yl)amino]methylidene]-2-bromanyl-6-ethoxy-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[(5-azanyl-1,2,3,4-tetrazol-1-yl)amino]methylidene]-2-bromanyl-6-ethoxy-cyclohexa-2,5-dien-1-one Openeye Name: 4-[[(5-aminotetrazol-1-yl)amino]methylene]-2-bromo-6-ethoxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[[(5-amino-1-tetrazolyl)amino]methylidene]-2-bromo-6-ethoxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[(5-aminotetrazol-1-yl)amino]methylidene]-2-bromo-6-ethoxycyclohexa-2,5-dien-1-one Traditional Name: 4-[[(5-aminotetrazol-1-yl)amino]methylene]-2-bromo-6-ethoxy-cyclohexa-2,5-dien-1-one Formula: C10H11BrN6O2 MolecularWeight: 327.13734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNN2C(=NN=N2)N)C=C(C1=O)Br

Isomeric SMILES

CCOC1=CC(=CNN2C(=NN=N2)N)C=C(C1=O)Br

InChI

InChI=1S/C10H11BrN6O2/c1-2-19-8-4-6(3-7(11)9(8)18)5-13-17-10(12)14-15-16-17/h3-5,13H,2H2,1H3,(H2,12,14,16)