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3-[(6,7-dimethoxy-1,3-benzodioxol-5-yl)oxy]propanenitrile

3-[(6,7-dimethoxy-1,3-benzodioxol-5-yl)oxy]propanenitrile

Systemtic Name:3-[(6,7-dimethoxy-1,3-benzodioxol-5-yl)oxy]propanenitrile
Openeye Name:3-[(6,7-dimethoxy-1,3-benzodioxol-5-yl)oxy]propanenitrile
CAS Name:3-[(6,7-dimethoxy-1,3-benzodioxol-5-yl)oxy]propanenitrile
IUPAC Name:3-[(6,7-dimethoxy-1,3-benzodioxol-5-yl)oxy]propanenitrile
Traditional Name:3-[(6,7-dimethoxy-1,3-benzodioxol-5-yl)oxy]propionitrile
Formula: C12H13NO5
MolecularWeight: 251.23532
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1OC)OCO2)OCCC#N


Isomeric SMILES

COC1=C(C=C2C(=C1OC)OCO2)OCCC#N


InChI

InChI=1S/C12H13NO5/c1-14-10-8(16-5-3-4-13)6-9-11(12(10)15-2)18-7-17-9/h6H,3,5,7H2,1-2H3


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