acridin-9-yl-[8-[4-(3-azaniumylpropylazaniumyl)butylazaniumyl]octyl]azanium tetrabromide

Systemtic Name: acridin-9-yl-[8-[4-(3-azaniumylpropylazaniumyl)butylazaniumyl]octyl]azanium tetrabromide Openeye Name: acridin-9-yl-[8-[4-(3-azaniumylpropylammonio)butylammonio]octyl]ammonium tetrabromide CAS Name: 9-acridinyl-[8-[4-(3-ammoniopropylammonio)butylammonio]octyl]ammonium tetrabromide IUPAC Name: acridin-9-yl-[8-[4-(3-azaniumylpropylazaniumyl)butylazaniumyl]octyl]azanium tetrabromide Traditional Name: acridin-9-yl-[8-[4-(3-ammoniopropylammonio)butylammonio]octyl]ammonium tetrabromide Formula: C28H47Br4N5 MolecularWeight: 773.32228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)[NH2+]CCCCCCCC[NH2+]CCCC[NH2+]CCC[NH3+].[Br-].[Br-].[Br-].[Br-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)[NH2+]CCCCCCCC[NH2+]CCCC[NH2+]CCC[NH3+].[Br-].[Br-].[Br-].[Br-]

InChI

InChI=1S/C28H43N5.4BrH/c29-18-13-22-31-21-12-11-20-30-19-9-3-1-2-4-10-23-32-28-24-14-5-7-16-26(24)33-27-17-8-6-15-25(27)28;;;;/h5-8,14-17,30-31H,1-4,9-13,18-23,29H2,(H,32,33);4*1H