2-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]methyl]pentanedinitrile

Systemtic Name: 2-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]methyl]pentanedinitrile Openeye Name: 2-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]methyl]pentanedinitrile CAS Name: 2-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-piperazinyl]methyl]pentanedinitrile IUPAC Name: 2-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]methyl]pentanedinitrile Traditional Name: 2-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazino]methyl]glutaronitrile Formula: C19H24N4O2 MolecularWeight: 340.41946

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCCO3)CC(CCC#N)C#N

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCCO3)CC(CCC#N)C#N

InChI

InChI=1S/C19H24N4O2/c20-5-1-2-17(13-21)15-23-8-6-22(7-9-23)14-16-3-4-18-19(12-16)25-11-10-24-18/h3-4,12,17H,1-2,6-11,14-15H2