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

Systemtic Name: 1-[4-[(6Z)-5-bromanyl-6-pyridin-1-ium-1-ylimino-pyridin-3-ylidene]cyclohexa-2,5-dien-1-ylidene]ethanolate Openeye Name: 1-[4-[(6Z)-5-bromo-6-pyridin-1-ium-1-ylimino-3-pyridylidene]cyclohexa-2,5-dien-1-ylidene]ethanolate CAS Name: 1-[4-[(6Z)-5-bromo-6-(1-pyridin-1-iumylimino)-3-pyridinylidene]-1-cyclohexa-2,5-dienylidene]ethanolate IUPAC Name: 1-[4-[(6Z)-5-bromo-6-pyridin-1-ium-1-yliminopyridin-3-ylidene]cyclohexa-2,5-dien-1-ylidene]ethanolate Traditional Name: 1-[4-[(6Z)-5-bromo-6-pyridin-1-ium-1-ylimino-3-pyridylidene]cyclohexa-2,5-dien-1-ylidene]ethanolate Formula: C18H14BrN3O MolecularWeight: 368.22726

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC(=C2C=C(C(=N[N+]3=CC=CC=C3)N=C2)Br)C=C1)[O-]

Isomeric SMILES

CC(=C1C=CC(=C2C=C(/C(=N/[N+]3=CC=CC=C3)/N=C2)Br)C=C1)[O-]

InChI

InChI=1S/C18H14BrN3O/c1-13(23)14-5-7-15(8-6-14)16-11-17(19)18(20-12-16)21-22-9-3-2-4-10-22/h2-12H,1H3