methyl-[2-[(2S,5S,6S)-5-oxidanyl-6-pyrrolidin-1-ylcarbonyl-oxan-2-yl]ethyl]-(2-pyridin-2-ylethyl)azanium

Systemtic Name: methyl-[2-[(2S,5S,6S)-5-oxidanyl-6-pyrrolidin-1-ylcarbonyl-oxan-2-yl]ethyl]-(2-pyridin-2-ylethyl)azanium Openeye Name: 2-[(2S,5S,6S)-5-hydroxy-6-(pyrrolidine-1-carbonyl)tetrahydropyran-2-yl]ethyl-methyl-[2-(2-pyridyl)ethyl]ammonium CAS Name: 2-[(2S,5S,6S)-5-hydroxy-6-[oxo(1-pyrrolidinyl)methyl]-2-oxanyl]ethyl-methyl-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: 2-[(2S,5S,6S)-5-hydroxy-6-(pyrrolidine-1-carbonyl)oxan-2-yl]ethyl-methyl-(2-pyridin-2-ylethyl)azanium Traditional Name: 2-[(2S,5S,6S)-5-hydroxy-6-(pyrrolidine-1-carbonyl)tetrahydropyran-2-yl]ethyl-methyl-[2-(2-pyridyl)ethyl]ammonium Formula: C20H32N3O3+ MolecularWeight: 362.48638

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1CCC(C(O1)C(=O)N2CCCC2)O)CCC3=CC=CC=N3

Isomeric SMILES

C[NH+](CC[C@@H]1CC[C@@H]([C@H](O1)C(=O)N2CCCC2)O)CCC3=CC=CC=N3

InChI

InChI=1S/C20H31N3O3/c1-22(14-9-16-6-2-3-11-21-16)15-10-17-7-8-18(24)19(26-17)20(25)23-12-4-5-13-23/h2-3,6,11,17-19,24H,4-5,7-10,12-15H2,1H3/p+1/t17-,18-,19-/m0/s1