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

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

Systemtic Name:2-(phenylmethyl)-2-(3-phenylpropyl)-1,3-dihydroisoindol-2-ium-5,6-diol
Openeye Name:2-benzyl-2-(3-phenylpropyl)isoindolin-2-ium-5,6-diol
CAS Name:2-(phenylmethyl)-2-(3-phenylpropyl)-1,3-dihydroisoindol-2-ium-5,6-diol
IUPAC Name:2-benzyl-2-(3-phenylpropyl)-1,3-dihydroisoindol-2-ium-5,6-diol
Traditional Name:2-benzyl-2-(3-phenylpropyl)isoindolin-2-ium-5,6-diol
Formula: C24H26NO2+
MolecularWeight: 360.46874
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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=C(C=C2C[N+]1(CCCC3=CC=CC=C3)CC4=CC=CC=C4)O)O


Isomeric SMILES

C1C2=CC(=C(C=C2C[N+]1(CCCC3=CC=CC=C3)CC4=CC=CC=C4)O)O


InChI

InChI=1S/C24H25NO2/c26-23-14-21-17-25(18-22(21)15-24(23)27,16-20-10-5-2-6-11-20)13-7-12-19-8-3-1-4-9-19/h1-6,8-11,14-15H,7,12-13,16-18H2,(H-,26,27)/p+1


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