3-[[(1S)-1-cyclopropylethyl]azaniumyl]propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-[[(1S)-1-cyclopropylethyl]azaniumyl]propyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-[[(1S)-1-cyclopropylethyl]ammonio]propyl]-methyl-ammonium CAS Name: 3-[[(1S)-1-cyclopropylethyl]ammonio]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[[(1S)-1-cyclopropylethyl]azaniumyl]propyl]-methylazanium Traditional Name: benzyl-[3-[[(1S)-1-cyclopropylethyl]ammonio]propyl]-methyl-ammonium Formula: C16H28N2+2 MolecularWeight: 248.40692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)[NH2+]CCC[NH+](C)CC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C1CC1)[NH2+]CCC[NH+](C)CC2=CC=CC=C2

InChI

InChI=1S/C16H26N2/c1-14(16-9-10-16)17-11-6-12-18(2)13-15-7-4-3-5-8-15/h3-5,7-8,14,16-17H,6,9-13H2,1-2H3/p+2/t14-/m0/s1