(1S,2R)-2-methyl-1-oxidanidyl-1-(phenylmethyl)piperidin-1-ium-3,5-diol

Systemtic Name: (1S,2R)-2-methyl-1-oxidanidyl-1-(phenylmethyl)piperidin-1-ium-3,5-diol Openeye Name: (1S,2R)-1-benzyl-2-methyl-1-oxido-piperidin-1-ium-3,5-diol CAS Name: (1S,2R)-2-methyl-1-oxido-1-(phenylmethyl)piperidin-1-ium-3,5-diol IUPAC Name: (1S,2R)-1-benzyl-2-methyl-1-oxidopiperidin-1-ium-3,5-diol Traditional Name: (1S,2R)-1-benzyl-2-methyl-1-oxido-piperidin-1-ium-3,5-diol Formula: C13H19NO3 MolecularWeight: 237.29486

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC(C[N+]1(CC2=CC=CC=C2)[O-])O)O

Isomeric SMILES

C[C@@H]1C(CC(C[N@+]1(CC2=CC=CC=C2)[O-])O)O

InChI

InChI=1S/C13H19NO3/c1-10-13(16)7-12(15)9-14(10,17)8-11-5-3-2-4-6-11/h2-6,10,12-13,15-16H,7-9H2,1H3/t10-,12?,13?,14+/m1/s1