methyl-[(2S)-3-(methylazaniumyl)-2-oxidanyl-propyl]-(2-pyridin-2-ylethyl)azanium

Systemtic Name: methyl-[(2S)-3-(methylazaniumyl)-2-oxidanyl-propyl]-(2-pyridin-2-ylethyl)azanium Openeye Name: [(2S)-2-hydroxy-3-(methylammonio)propyl]-methyl-[2-(2-pyridyl)ethyl]ammonium CAS Name: [(2S)-2-hydroxy-3-(methylammonio)propyl]-methyl-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: [(2S)-2-hydroxy-3-(methylazaniumyl)propyl]-methyl-(2-pyridin-2-ylethyl)azanium Traditional Name: [(2S)-2-hydroxy-3-(methylammonio)propyl]-methyl-[2-(2-pyridyl)ethyl]ammonium Formula: C12H23N3O+2 MolecularWeight: 225.33052

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC(C[NH+](C)CCC1=CC=CC=N1)O

Isomeric SMILES

C[NH2+]C[C@@H](C[NH+](C)CCC1=CC=CC=N1)O

InChI

InChI=1S/C12H21N3O/c1-13-9-12(16)10-15(2)8-6-11-5-3-4-7-14-11/h3-5,7,12-13,16H,6,8-10H2,1-2H3/p+2/t12-/m0/s1