4-(1,3-benzodioxol-5-ylmethoxymethyl)-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethoxymethyl)-3-fluoranyl-benzenecarbonitrile Openeye Name: 4-(1,3-benzodioxol-5-ylmethoxymethyl)-3-fluoro-benzonitrile CAS Name: 4-(1,3-benzodioxol-5-ylmethoxymethyl)-3-fluorobenzonitrile IUPAC Name: 4-(1,3-benzodioxol-5-ylmethoxymethyl)-3-fluorobenzonitrile Traditional Name: 3-fluoro-4-(piperonyloxymethyl)benzonitrile Formula: C16H12FNO3 MolecularWeight: 285.269783

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)COCC3=C(C=C(C=C3)C#N)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)COCC3=C(C=C(C=C3)C#N)F

InChI

InChI=1S/C16H12FNO3/c17-14-5-11(7-18)1-3-13(14)9-19-8-12-2-4-15-16(6-12)21-10-20-15/h1-6H,8-10H2