methyl-[3-[[(3S,5S)-5-methylheptan-3-yl]azaniumyl]propyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[3-[[(3S,5S)-5-methylheptan-3-yl]azaniumyl]propyl]-(phenylmethyl)azanium Openeye Name: benzyl-[3-[[(1S,3S)-1-ethyl-3-methyl-pentyl]ammonio]propyl]-methyl-ammonium CAS Name: methyl-[3-[[(3S,5S)-5-methylheptan-3-yl]ammonio]propyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[3-[[(3S,5S)-5-methylheptan-3-yl]azaniumyl]propyl]azanium Traditional Name: benzyl-[3-[[(1S,3S)-1-ethyl-3-methyl-pentyl]ammonio]propyl]-methyl-ammonium Formula: C19H36N2+2 MolecularWeight: 292.50254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H34N2/c1-5-17(3)15-19(6-2)20-13-10-14-21(4)16-18-11-8-7-9-12-18/h7-9,11-12,17,19-20H,5-6,10,13-16H2,1-4H3/p+2/t17-,19-/m0/s1