1-[4-[(3Z)-6-bromanyl-3-pyridin-1-ium-1-ylimino-pyrazin-2-ylidene]cyclohexa-2,5-dien-1-ylidene]ethanolate

Systemtic Name: 1-[4-[(3Z)-6-bromanyl-3-pyridin-1-ium-1-ylimino-pyrazin-2-ylidene]cyclohexa-2,5-dien-1-ylidene]ethanolate Openeye Name: 1-[4-[(3Z)-6-bromo-3-pyridin-1-ium-1-ylimino-pyrazin-2-ylidene]cyclohexa-2,5-dien-1-ylidene]ethanolate CAS Name: 1-[4-[(3Z)-6-bromo-3-(1-pyridin-1-iumylimino)-2-pyrazinylidene]-1-cyclohexa-2,5-dienylidene]ethanolate IUPAC Name: 1-[4-[(3Z)-6-bromo-3-pyridin-1-ium-1-yliminopyrazin-2-ylidene]cyclohexa-2,5-dien-1-ylidene]ethanolate Traditional Name: 1-[4-[(3Z)-6-bromo-3-pyridin-1-ium-1-ylimino-pyrazin-2-ylidene]cyclohexa-2,5-dien-1-ylidene]ethanolate Formula: C17H13BrN4O MolecularWeight: 369.21532

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC(=C2C(=N[N+]3=CC=CC=C3)N=CC(=N2)Br)C=C1)[O-]

Isomeric SMILES

CC(=C1C=CC(=C2/C(=N/[N+]3=CC=CC=C3)/N=CC(=N2)Br)C=C1)[O-]

InChI

InChI=1S/C17H13BrN4O/c1-12(23)13-5-7-14(8-6-13)16-17(19-11-15(18)20-16)21-22-9-3-2-4-10-22/h2-11H,1H3