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

Systemtic Name: methyl-[3-[[(2S)-octan-2-yl]azaniumyl]propyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[3-[[(1S)-1-methylheptyl]ammonio]propyl]ammonium CAS Name: methyl-[3-[[(2S)-octan-2-yl]ammonio]propyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[3-[[(2S)-octan-2-yl]azaniumyl]propyl]azanium Traditional Name: benzyl-methyl-[3-[[(1S)-1-methylheptyl]ammonio]propyl]ammonium Formula: C19H36N2+2 MolecularWeight: 292.50254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H34N2/c1-4-5-6-8-12-18(2)20-15-11-16-21(3)17-19-13-9-7-10-14-19/h7,9-10,13-14,18,20H,4-6,8,11-12,15-17H2,1-3H3/p+2/t18-/m0/s1