(2S,3S)-3-(1-oxidanidylpyridin-1-ium-2-yl)-2,3-dihydro-1H-indene-1,2-diol

Systemtic Name: (2S,3S)-3-(1-oxidanidylpyridin-1-ium-2-yl)-2,3-dihydro-1H-indene-1,2-diol Openeye Name: (2S,3S)-3-(1-oxidopyridin-1-ium-2-yl)indane-1,2-diol CAS Name: (2S,3S)-3-(1-oxido-2-pyridin-1-iumyl)-2,3-dihydro-1H-indene-1,2-diol IUPAC Name: (2S,3S)-3-(1-oxidopyridin-1-ium-2-yl)-2,3-dihydro-1H-indene-1,2-diol Traditional Name: (2S,3S)-3-(1-oxidopyridin-1-ium-2-yl)indane-1,2-diol Formula: C14H13NO3 MolecularWeight: 243.25792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(C(C(C2=C1)C3=CC=CC=[N+]3[O-])O)O

Isomeric SMILES

C1=CC=C2C([C@H]([C@@H](C2=C1)C3=CC=CC=[N+]3[O-])O)O

InChI

InChI=1S/C14H13NO3/c16-13-10-6-2-1-5-9(10)12(14(13)17)11-7-3-4-8-15(11)18/h1-8,12-14,16-17H/t12-,13?,14-/m0/s1