2-(2-methylpropyl)-2-(phenylmethyl)-1,3-dihydroisoindol-2-ium-5,6-diol

Systemtic Name: 2-(2-methylpropyl)-2-(phenylmethyl)-1,3-dihydroisoindol-2-ium-5,6-diol Openeye Name: 2-benzyl-2-isobutyl-isoindolin-2-ium-5,6-diol CAS Name: 2-(2-methylpropyl)-2-(phenylmethyl)-1,3-dihydroisoindol-2-ium-5,6-diol IUPAC Name: 2-benzyl-2-(2-methylpropyl)-1,3-dihydroisoindol-2-ium-5,6-diol Traditional Name: 2-benzyl-2-isobutyl-isoindolin-2-ium-5,6-diol Formula: C19H24NO2+ MolecularWeight: 298.39936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[N+]1(CC2=CC(=C(C=C2C1)O)O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)C[N+]1(CC2=CC(=C(C=C2C1)O)O)CC3=CC=CC=C3

InChI

InChI=1S/C19H23NO2/c1-14(2)10-20(11-15-6-4-3-5-7-15)12-16-8-18(21)19(22)9-17(16)13-20/h3-9,14H,10-13H2,1-2H3,(H-,21,22)/p+1