7-(5,6-dimethoxy-1,3-dihydroisoindol-2-yl)heptanenitrile hydrochloride

Systemtic Name: 7-(5,6-dimethoxy-1,3-dihydroisoindol-2-yl)heptanenitrile hydrochloride Openeye Name: 7-(5,6-dimethoxyisoindolin-2-yl)heptanenitrile hydrochloride CAS Name: 7-(5,6-dimethoxy-1,3-dihydroisoindol-2-yl)heptanenitrile hydrochloride IUPAC Name: 7-(5,6-dimethoxy-1,3-dihydroisoindol-2-yl)heptanenitrile hydrochloride Traditional Name: 7-(5,6-dimethoxyisoindolin-2-yl)enanthonitrile hydrochloride Formula: C17H25ClN2O2 MolecularWeight: 324.8456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CC2=C1)CCCCCCC#N)OC.Cl

Isomeric SMILES

COC1=C(C=C2CN(CC2=C1)CCCCCCC#N)OC.Cl

InChI

InChI=1S/C17H24N2O2.ClH/c1-20-16-10-14-12-19(9-7-5-3-4-6-8-18)13-15(14)11-17(16)21-2;/h10-11H,3-7,9,12-13H2,1-2H3;1H