2-[4-(1-methylindol-3-yl)-2,6-diphenyl-pyridin-1-ium-1-yl]ethanol bromide

Systemtic Name: 2-[4-(1-methylindol-3-yl)-2,6-diphenyl-pyridin-1-ium-1-yl]ethanol bromide Openeye Name: 2-[4-(1-methylindol-3-yl)-2,6-diphenyl-pyridin-1-ium-1-yl]ethanol bromide CAS Name: 2-[4-(1-methyl-3-indolyl)-2,6-diphenyl-1-pyridin-1-iumyl]ethanol bromide IUPAC Name: 2-[4-(1-methylindol-3-yl)-2,6-diphenylpyridin-1-ium-1-yl]ethanol bromide Traditional Name: 2-[4-(1-methylindol-3-yl)-2,6-diphenyl-pyridin-1-ium-1-yl]ethanol bromide Formula: C28H25BrN2O MolecularWeight: 485.4149

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C3=CC(=[N+](C(=C3)C4=CC=CC=C4)CCO)C5=CC=CC=C5.[Br-]

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C3=CC(=[N+](C(=C3)C4=CC=CC=C4)CCO)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C28H25N2O.BrH/c1-29-20-25(24-14-8-9-15-26(24)29)23-18-27(21-10-4-2-5-11-21)30(16-17-31)28(19-23)22-12-6-3-7-13-22;/h2-15,18-20,31H,16-17H2,1H3;1H/q+1;/p-1