(1R,2S,3S,4R)-2-methyl-1-oxidanidyl-1-(phenylmethyl)pyrrolidin-1-ium-3,4-diol

Systemtic Name: (1R,2S,3S,4R)-2-methyl-1-oxidanidyl-1-(phenylmethyl)pyrrolidin-1-ium-3,4-diol Openeye Name: (1R,2S,3S,4R)-1-benzyl-2-methyl-1-oxido-pyrrolidin-1-ium-3,4-diol CAS Name: (1R,2S,3S,4R)-2-methyl-1-oxido-1-(phenylmethyl)pyrrolidin-1-ium-3,4-diol IUPAC Name: (1R,2S,3S,4R)-1-benzyl-2-methyl-1-oxidopyrrolidin-1-ium-3,4-diol Traditional Name: (1R,2S,3S,4R)-1-benzyl-2-methyl-1-oxido-pyrrolidin-1-ium-3,4-diol Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO3/c1-9-12(15)11(14)8-13(9,16)7-10-5-3-2-4-6-10/h2-6,9,11-12,14-15H,7-8H2,1H3/t9-,11+,12-,13+/m0/s1