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

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

Systemtic Name:2-phenethyl-2-(phenylmethyl)-1,3-dihydroisoindol-2-ium-5,6-diol
Openeye Name:2-benzyl-2-phenethyl-isoindolin-2-ium-5,6-diol
CAS Name:2-phenethyl-2-(phenylmethyl)-1,3-dihydroisoindol-2-ium-5,6-diol
IUPAC Name:2-benzyl-2-phenethyl-1,3-dihydroisoindol-2-ium-5,6-diol
Traditional Name:2-benzyl-2-phenethyl-isoindolin-2-ium-5,6-diol
Formula: C23H24NO2+
MolecularWeight: 346.44216
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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=C(C=C2C[N+]1(CCC3=CC=CC=C3)CC4=CC=CC=C4)O)O


Isomeric SMILES

C1C2=CC(=C(C=C2C[N+]1(CCC3=CC=CC=C3)CC4=CC=CC=C4)O)O


InChI

InChI=1S/C23H23NO2/c25-22-13-20-16-24(17-21(20)14-23(22)26,15-19-9-5-2-6-10-19)12-11-18-7-3-1-4-8-18/h1-10,13-14H,11-12,15-17H2,(H-,25,26)/p+1


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