anthracen-9-ylmethyl-[5-(4-azaniumylbutylazaniumyl)pentyl]azanium trichloride

Systemtic Name: anthracen-9-ylmethyl-[5-(4-azaniumylbutylazaniumyl)pentyl]azanium trichloride Openeye Name: 9-anthrylmethyl-[5-(4-azaniumylbutylammonio)pentyl]ammonium trichloride CAS Name: 4-ammoniobutyl-[5-(9-anthracenylmethylammonio)pentyl]ammonium trichloride IUPAC Name: anthracen-9-ylmethyl-[5-(4-azaniumylbutylazaniumyl)pentyl]azanium trichloride Traditional Name: 4-ammoniobutyl-[5-(9-anthrylmethylammonio)pentyl]ammonium trichloride Formula: C24H36Cl3N3 MolecularWeight: 472.92174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C[NH2+]CCCCC[NH2+]CCCC[NH3+].[Cl-].[Cl-].[Cl-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C[NH2+]CCCCC[NH2+]CCCC[NH3+].[Cl-].[Cl-].[Cl-]

InChI

InChI=1S/C24H33N3.3ClH/c25-14-6-9-16-26-15-7-1-8-17-27-19-24-22-12-4-2-10-20(22)18-21-11-3-5-13-23(21)24;;;/h2-5,10-13,18,26-27H,1,6-9,14-17,19,25H2;3*1H