(4E)-2-bromanyl-4-(1,2-dihydro-1,2,3,4-tetrazol-5-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-2-bromanyl-4-(1,2-dihydro-1,2,3,4-tetrazol-5-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: (4E)-2-bromo-4-(1,2-dihydrotetrazol-5-ylidene)cyclohexa-2,5-dien-1-one CAS Name: (4E)-2-bromo-4-(1,2-dihydrotetrazol-5-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-2-bromo-4-(1,2-dihydrotetrazol-5-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: (4E)-2-bromo-4-(1,2-dihydrotetrazol-5-ylidene)cyclohexa-2,5-dien-1-one Formula: C7H5BrN4O MolecularWeight: 241.0448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=CC1=C2NNN=N2)Br

Isomeric SMILES

C\1=CC(=O)C(=C/C1=C/2\NNN=N2)Br

InChI

InChI=1S/C7H5BrN4O/c8-5-3-4(1-2-6(5)13)7-9-11-12-10-7/h1-3H,(H,9,12)(H,10,11)