3-[[(1S)-1-(4-bromophenyl)propyl]azaniumyl]propyl-dimethyl-azanium

Systemtic Name: 3-[[(1S)-1-(4-bromophenyl)propyl]azaniumyl]propyl-dimethyl-azanium Openeye Name: 3-[[(1S)-1-(4-bromophenyl)propyl]ammonio]propyl-dimethyl-ammonium CAS Name: 3-[[(1S)-1-(4-bromophenyl)propyl]ammonio]propyl-dimethylammonium IUPAC Name: 3-[[(1S)-1-(4-bromophenyl)propyl]azaniumyl]propyl-dimethylazanium Traditional Name: 3-[[(1S)-1-(4-bromophenyl)propyl]ammonio]propyl-dimethyl-ammonium Formula: C14H25BrN2+2 MolecularWeight: 301.2657

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Br)[NH2+]CCC[NH+](C)C

Isomeric SMILES

CC[C@@H](C1=CC=C(C=C1)Br)[NH2+]CCC[NH+](C)C

InChI

InChI=1S/C14H23BrN2/c1-4-14(16-10-5-11-17(2)3)12-6-8-13(15)9-7-12/h6-9,14,16H,4-5,10-11H2,1-3H3/p+2/t14-/m0/s1