3-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methoxy]benzenecarbonitrile

Systemtic Name: 3-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methoxy]benzenecarbonitrile Openeye Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methoxy]benzonitrile CAS Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methoxy]benzonitrile IUPAC Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methoxy]benzonitrile Traditional Name: 3-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methoxy]benzonitrile Formula: C16H12BrNO3 MolecularWeight: 346.17538

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)COC3=CC=CC(=C3)C#N

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)COC3=CC=CC(=C3)C#N

InChI

InChI=1S/C16H12BrNO3/c17-14-8-16-15(19-4-5-20-16)7-12(14)10-21-13-3-1-2-11(6-13)9-18/h1-3,6-8H,4-5,10H2