oxidanylidene-[[1-[(E)-4-quinolin-1-ium-1-ylbut-2-enyl]pyridin-4-ylidene]methyl]azanium dibromide

Systemtic Name: oxidanylidene-[[1-[(E)-4-quinolin-1-ium-1-ylbut-2-enyl]pyridin-4-ylidene]methyl]azanium dibromide Openeye Name: oxo-[[1-[(E)-4-quinolin-1-ium-1-ylbut-2-enyl]-4-pyridylidene]methyl]ammonium dibromide CAS Name: oxo-[[1-[(E)-4-(1-quinolin-1-iumyl)but-2-enyl]-4-pyridinylidene]methyl]ammonium dibromide IUPAC Name: oxo-[[1-[(E)-4-quinolin-1-ium-1-ylbut-2-enyl]pyridin-4-ylidene]methyl]azanium dibromide Traditional Name: keto-[[1-[(E)-4-quinolin-1-ium-1-ylbut-2-enyl]-4-pyridylidene]methyl]ammonium dibromide Formula: C19H19Br2N3O MolecularWeight: 465.18166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=[N+]2CC=CCN3C=CC(=C[NH+]=O)C=C3.[Br-].[Br-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=[N+]2C/C=C/CN3C=CC(=C[NH+]=O)C=C3.[Br-].[Br-]

InChI

InChI=1S/C19H18N3O.2BrH/c23-20-16-17-9-14-21(15-10-17)11-3-4-12-22-13-5-7-18-6-1-2-8-19(18)22;;/h1-10,13-16H,11-12H2;2*1H/q+1;;/p-1/b4-3+;;