6-isoquinolin-4-yl-2,3-dimethoxy-benzoic acid

Systemtic Name: 6-isoquinolin-4-yl-2,3-dimethoxy-benzoic acid Openeye Name: 6-(4-isoquinolyl)-2,3-dimethoxy-benzoic acid CAS Name: 6-(4-isoquinolinyl)-2,3-dimethoxybenzoic acid IUPAC Name: 6-isoquinolin-4-yl-2,3-dimethoxybenzoic acid Traditional Name: 6-(4-isoquinolyl)-2,3-dimethoxy-benzoic acid Formula: C18H15NO4 MolecularWeight: 309.316

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2=CN=CC3=CC=CC=C32)C(=O)O)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2=CN=CC3=CC=CC=C32)C(=O)O)OC

InChI

InChI=1S/C18H15NO4/c1-22-15-8-7-13(16(18(20)21)17(15)23-2)14-10-19-9-11-5-3-4-6-12(11)14/h3-10H,1-2H3,(H,20,21)