3-(1,3-benzodioxol-5-yl)-4-(bromomethyl)benzenecarbonitrile

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-4-(bromomethyl)benzenecarbonitrile Openeye Name: 3-(1,3-benzodioxol-5-yl)-4-(bromomethyl)benzonitrile CAS Name: 3-(1,3-benzodioxol-5-yl)-4-(bromomethyl)benzonitrile IUPAC Name: 3-(1,3-benzodioxol-5-yl)-4-(bromomethyl)benzonitrile Traditional Name: 3-(1,3-benzodioxol-5-yl)-4-(bromomethyl)benzonitrile Formula: C15H10BrNO2 MolecularWeight: 316.1494

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C(C=CC(=C3)C#N)CBr

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C(C=CC(=C3)C#N)CBr

InChI

InChI=1S/C15H10BrNO2/c16-7-12-2-1-10(8-17)5-13(12)11-3-4-14-15(6-11)19-9-18-14/h1-6H,7,9H2