(5-bromanyl-1,3-benzodioxol-4-yl)-(1H-isoquinolin-2-yl)methanone

Systemtic Name: (5-bromanyl-1,3-benzodioxol-4-yl)-(1H-isoquinolin-2-yl)methanone Openeye Name: (5-bromo-1,3-benzodioxol-4-yl)-(1H-isoquinolin-2-yl)methanone CAS Name: (5-bromo-1,3-benzodioxol-4-yl)-(1H-isoquinolin-2-yl)methanone IUPAC Name: (5-bromo-1,3-benzodioxol-4-yl)-(1H-isoquinolin-2-yl)methanone Traditional Name: (5-bromo-1,3-benzodioxol-4-yl)-(1H-isoquinolin-2-yl)methanone Formula: C17H12BrNO3 MolecularWeight: 358.18608

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C=CN1C(=O)C3=C(C=CC4=C3OCO4)Br

Isomeric SMILES

C1C2=CC=CC=C2C=CN1C(=O)C3=C(C=CC4=C3OCO4)Br

InChI

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