2,3-dihydroisoindol-1-one dihydrate hydrochloride

Systemtic Name: 2,3-dihydroisoindol-1-one dihydrate hydrochloride Openeye Name: isoindolin-1-one dihydrate hydrochloride CAS Name: 2,3-dihydroisoindol-1-one dihydrate hydrochloride IUPAC Name: 2,3-dihydroisoindol-1-one dihydrate hydrochloride Traditional Name: isoindolin-1-one dihydrate hydrochloride Formula: C8H12ClNO3 MolecularWeight: 205.63878

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N1.O.O.Cl

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N1.O.O.Cl

InChI

InChI=1S/C8H7NO.ClH.2H2O/c10-8-7-4-2-1-3-6(7)5-9-8;;;/h1-4H,5H2,(H,9,10);1H;2*1H2