(5-bromanyl-1,3-benzodioxol-4-yl)-isoquinolin-5-yl-methanol

Systemtic Name: (5-bromanyl-1,3-benzodioxol-4-yl)-isoquinolin-5-yl-methanol Openeye Name: (5-bromo-1,3-benzodioxol-4-yl)-(5-isoquinolyl)methanol CAS Name: (5-bromo-1,3-benzodioxol-4-yl)-(5-isoquinolinyl)methanol IUPAC Name: (5-bromo-1,3-benzodioxol-4-yl)-isoquinolin-5-ylmethanol Traditional Name: (5-bromo-1,3-benzodioxol-4-yl)-(5-isoquinolyl)methanol Formula: C17H12BrNO3 MolecularWeight: 358.18608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=C(C=C2)Br)C(C3=CC=CC4=C3C=CN=C4)O

Isomeric SMILES

C1OC2=C(O1)C(=C(C=C2)Br)C(C3=CC=CC4=C3C=CN=C4)O

InChI

InChI=1S/C17H12BrNO3/c18-13-4-5-14-17(22-9-21-14)15(13)16(20)12-3-1-2-10-8-19-7-6-11(10)12/h1-8,16,20H,9H2