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

Systemtic Name: 3-[[(2S)-butan-2-yl]azaniumyl]propyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[3-[[(1S)-1-methylpropyl]ammonio]propyl]ammonium CAS Name: 3-[[(2S)-butan-2-yl]ammonio]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[[(2S)-butan-2-yl]azaniumyl]propyl]-methylazanium Traditional Name: benzyl-methyl-[3-[[(1S)-1-methylpropyl]ammonio]propyl]ammonium Formula: C15H28N2+2 MolecularWeight: 236.39622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H26N2/c1-4-14(2)16-11-8-12-17(3)13-15-9-6-5-7-10-15/h5-7,9-10,14,16H,4,8,11-13H2,1-3H3/p+2/t14-/m0/s1