methyl-[(2S)-3-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]-2-oxidanyl-propyl]azanium

Systemtic Name: methyl-[(2S)-3-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]-2-oxidanyl-propyl]azanium Openeye Name: [(2S)-2-hydroxy-3-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]propyl]-methyl-ammonium CAS Name: [(2S)-2-hydroxy-3-[methyl-(1-methyl-4-piperidin-1-iumyl)amino]propyl]-methylammonium IUPAC Name: [(2S)-2-hydroxy-3-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]propyl]-methylazanium Traditional Name: [(2S)-2-hydroxy-3-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]propyl]-methyl-ammonium Formula: C11H27N3O+2 MolecularWeight: 217.35158

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC(CN(C)C1CC[NH+](CC1)C)O

Isomeric SMILES

C[NH2+]C[C@@H](CN(C)C1CC[NH+](CC1)C)O

InChI

InChI=1S/C11H25N3O/c1-12-8-11(15)9-14(3)10-4-6-13(2)7-5-10/h10-12,15H,4-9H2,1-3H3/p+2/t11-/m0/s1