3-azanylpropyl-[3-[3-[bis(phenylmethyl)amino]propyl-dimethyl-azaniumyl]propyl]-dimethyl-azanium

Systemtic Name: 3-azanylpropyl-[3-[3-[bis(phenylmethyl)amino]propyl-dimethyl-azaniumyl]propyl]-dimethyl-azanium Openeye Name: 3-aminopropyl-[3-[3-(dibenzylamino)propyl-dimethyl-ammonio]propyl]-dimethyl-ammonium CAS Name: 3-aminopropyl-[3-[3-[bis(phenylmethyl)amino]propyl-dimethylammonio]propyl]-dimethylammonium IUPAC Name: 3-aminopropyl-[3-[3-(dibenzylamino)propyl-dimethylazaniumyl]propyl]-dimethylazanium Traditional Name: 3-aminopropyl-[3-[3-(dibenzylamino)propyl-dimethyl-ammonio]propyl]-dimethyl-ammonium Formula: C27H46N4+2 MolecularWeight: 426.68094

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCN)CCC[N+](C)(C)CCCN(CC1=CC=CC=C1)CC2=CC=CC=C2

Isomeric SMILES

C[N+](C)(CCCN)CCC[N+](C)(C)CCCN(CC1=CC=CC=C1)CC2=CC=CC=C2

InChI

InChI=1S/C27H46N4/c1-30(2,20-11-18-28)22-13-23-31(3,4)21-12-19-29(24-26-14-7-5-8-15-26)25-27-16-9-6-10-17-27/h5-10,14-17H,11-13,18-25,28H2,1-4H3/q+2