methyl-(phenylmethyl)-[3-[[(1S)-1-pyridin-2-ylethyl]azaniumyl]propyl]azanium

Systemtic Name: methyl-(phenylmethyl)-[3-[[(1S)-1-pyridin-2-ylethyl]azaniumyl]propyl]azanium Openeye Name: benzyl-methyl-[3-[[(1S)-1-(2-pyridyl)ethyl]ammonio]propyl]ammonium CAS Name: methyl-(phenylmethyl)-[3-[[(1S)-1-(2-pyridinyl)ethyl]ammonio]propyl]ammonium IUPAC Name: benzyl-methyl-[3-[[(1S)-1-pyridin-2-ylethyl]azaniumyl]propyl]azanium Traditional Name: benzyl-methyl-[3-[[(1S)-1-(2-pyridyl)ethyl]ammonio]propyl]ammonium Formula: C18H27N3+2 MolecularWeight: 285.42708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=N1)[NH2+]CCC[NH+](C)CC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C1=CC=CC=N1)[NH2+]CCC[NH+](C)CC2=CC=CC=C2

InChI

InChI=1S/C18H25N3/c1-16(18-11-6-7-12-20-18)19-13-8-14-21(2)15-17-9-4-3-5-10-17/h3-7,9-12,16,19H,8,13-15H2,1-2H3/p+2/t16-/m0/s1