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

Systemtic Name: methyl-[3-[[(2S)-3-methylbutan-2-yl]azaniumyl]propyl]-(phenylmethyl)azanium Openeye Name: benzyl-[3-[[(1S)-1,2-dimethylpropyl]ammonio]propyl]-methyl-ammonium CAS Name: methyl-[3-[[(2S)-3-methylbutan-2-yl]ammonio]propyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[3-[[(2S)-3-methylbutan-2-yl]azaniumyl]propyl]azanium Traditional Name: benzyl-[3-[[(1S)-1,2-dimethylpropyl]ammonio]propyl]-methyl-ammonium Formula: C16H30N2+2 MolecularWeight: 250.4228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N2/c1-14(2)15(3)17-11-8-12-18(4)13-16-9-6-5-7-10-16/h5-7,9-10,14-15,17H,8,11-13H2,1-4H3/p+2/t15-/m0/s1