methyl-[3-[[(2S)-5-methylhexan-2-yl]azaniumyl]propyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[3-[[(2S)-5-methylhexan-2-yl]azaniumyl]propyl]-(phenylmethyl)azanium Openeye Name: benzyl-[3-[[(1S)-1,4-dimethylpentyl]ammonio]propyl]-methyl-ammonium CAS Name: methyl-[3-[[(2S)-5-methylhexan-2-yl]ammonio]propyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[3-[[(2S)-5-methylhexan-2-yl]azaniumyl]propyl]azanium Traditional Name: benzyl-[3-[[(1S)-1,4-dimethylpentyl]ammonio]propyl]-methyl-ammonium Formula: C18H34N2+2 MolecularWeight: 278.47596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)[NH2+]CCC[NH+](C)CC1=CC=CC=C1

Isomeric SMILES

C[C@@H](CCC(C)C)[NH2+]CCC[NH+](C)CC1=CC=CC=C1

InChI

InChI=1S/C18H32N2/c1-16(2)11-12-17(3)19-13-8-14-20(4)15-18-9-6-5-7-10-18/h5-7,9-10,16-17,19H,8,11-15H2,1-4H3/p+2/t17-/m0/s1