7-bromanyl-4-methoxy-isoquinoline-3-carboxylic acid

Systemtic Name: 7-bromanyl-4-methoxy-isoquinoline-3-carboxylic acid Openeye Name: 7-bromo-4-methoxy-isoquinoline-3-carboxylic acid CAS Name: 7-bromo-4-methoxy-3-isoquinolinecarboxylic acid IUPAC Name: 7-bromo-4-methoxyisoquinoline-3-carboxylic acid Traditional Name: 7-bromo-4-methoxy-isoquinoline-3-carboxylic acid Formula: C11H8BrNO3 MolecularWeight: 282.09012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C=CC(=CC2=CN=C1C(=O)O)Br

Isomeric SMILES

COC1=C2C=CC(=CC2=CN=C1C(=O)O)Br

InChI

InChI=1S/C11H8BrNO3/c1-16-10-8-3-2-7(12)4-6(8)5-13-9(10)11(14)15/h2-5H,1H3,(H,14,15)