4-(1,3-benzodioxol-5-yl)oxane-4-carbonitrile

Systemtic Name: 4-(1,3-benzodioxol-5-yl)oxane-4-carbonitrile Openeye Name: 4-(1,3-benzodioxol-5-yl)tetrahydropyran-4-carbonitrile CAS Name: 4-(1,3-benzodioxol-5-yl)-4-oxanecarbonitrile IUPAC Name: 4-(1,3-benzodioxol-5-yl)oxane-4-carbonitrile Traditional Name: 4-(1,3-benzodioxol-5-yl)tetrahydropyran-4-carbonitrile Formula: C13H13NO3 MolecularWeight: 231.24722

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C#N)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1COCCC1(C#N)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C13H13NO3/c14-8-13(3-5-15-6-4-13)10-1-2-11-12(7-10)17-9-16-11/h1-2,7H,3-6,9H2