1-[2-(9H-fluoren-2-yl)-2-oxidanylidene-ethyl]pyridin-1-ium-3-carbonitrile bromide

Systemtic Name: 1-[2-(9H-fluoren-2-yl)-2-oxidanylidene-ethyl]pyridin-1-ium-3-carbonitrile bromide Openeye Name: 1-[2-(9H-fluoren-2-yl)-2-oxo-ethyl]pyridin-1-ium-3-carbonitrile bromide CAS Name: 1-[2-(9H-fluoren-2-yl)-2-oxoethyl]-3-pyridin-1-iumcarbonitrile bromide IUPAC Name: 1-[2-(9H-fluoren-2-yl)-2-oxoethyl]pyridin-1-ium-3-carbonitrile bromide Traditional Name: 1-[2-(9H-fluoren-2-yl)-2-keto-ethyl]pyridin-1-ium-3-carbonitrile bromide Formula: C21H15BrN2O MolecularWeight: 391.2606

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C3=C1C=C(C=C3)C(=O)C[N+]4=CC=CC(=C4)C#N.[Br-]

Isomeric SMILES

C1C2=CC=CC=C2C3=C1C=C(C=C3)C(=O)C[N+]4=CC=CC(=C4)C#N.[Br-]

InChI

InChI=1S/C21H15N2O.BrH/c22-12-15-4-3-9-23(13-15)14-21(24)17-7-8-20-18(11-17)10-16-5-1-2-6-19(16)20;/h1-9,11,13H,10,14H2;1H/q+1;/p-1