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2-(1,3-benzodioxol-5-ylmethyl)-1H-isoquinoline-1-carbonitrile

2-(1,3-benzodioxol-5-ylmethyl)-1H-isoquinoline-1-carbonitrile

Systemtic Name:2-(1,3-benzodioxol-5-ylmethyl)-1H-isoquinoline-1-carbonitrile
Openeye Name:2-(1,3-benzodioxol-5-ylmethyl)-1H-isoquinoline-1-carbonitrile
CAS Name:2-(1,3-benzodioxol-5-ylmethyl)-1H-isoquinoline-1-carbonitrile
IUPAC Name:2-(1,3-benzodioxol-5-ylmethyl)-1H-isoquinoline-1-carbonitrile
Traditional Name:2-piperonyl-1H-isoquinoline-1-carbonitrile
Formula: C18H14N2O2
MolecularWeight: 290.31596
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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C=CC4=CC=CC=C4C3C#N


Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C=CC4=CC=CC=C4C3C#N


InChI

InChI=1S/C18H14N2O2/c19-10-16-15-4-2-1-3-14(15)7-8-20(16)11-13-5-6-17-18(9-13)22-12-21-17/h1-9,16H,11-12H2


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