3-bromanyl-4-(2,3-dihydro-1,4-benzodioxin-5-ylmethylamino)benzenecarbonitrile

Systemtic Name: 3-bromanyl-4-(2,3-dihydro-1,4-benzodioxin-5-ylmethylamino)benzenecarbonitrile Openeye Name: 3-bromo-4-(2,3-dihydro-1,4-benzodioxin-5-ylmethylamino)benzonitrile CAS Name: 3-bromo-4-(2,3-dihydro-1,4-benzodioxin-5-ylmethylamino)benzonitrile IUPAC Name: 3-bromo-4-(2,3-dihydro-1,4-benzodioxin-5-ylmethylamino)benzonitrile Traditional Name: 3-bromo-4-(2,3-dihydro-1,4-benzodioxin-5-ylmethylamino)benzonitrile Formula: C16H13BrN2O2 MolecularWeight: 345.19062

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=CC=C2O1)CNC3=C(C=C(C=C3)C#N)Br

Isomeric SMILES

C1COC2=C(C=CC=C2O1)CNC3=C(C=C(C=C3)C#N)Br

InChI

InChI=1S/C16H13BrN2O2/c17-13-8-11(9-18)4-5-14(13)19-10-12-2-1-3-15-16(12)21-7-6-20-15/h1-5,8,19H,6-7,10H2