methyl 4-(6,7-dimethoxy-3-phenyl-isoquinolin-4-yl)benzoate

Systemtic Name: methyl 4-(6,7-dimethoxy-3-phenyl-isoquinolin-4-yl)benzoate Openeye Name: methyl 4-(6,7-dimethoxy-3-phenyl-4-isoquinolyl)benzoate CAS Name: 4-(6,7-dimethoxy-3-phenyl-4-isoquinolinyl)benzoic acid methyl ester IUPAC Name: methyl 4-(6,7-dimethoxy-3-phenylisoquinolin-4-yl)benzoate Traditional Name: 4-(6,7-dimethoxy-3-phenyl-4-isoquinolyl)benzoic acid methyl ester Formula: C25H21NO4 MolecularWeight: 399.43854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=NC(=C2C3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=NC(=C2C3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4)OC

InChI

InChI=1S/C25H21NO4/c1-28-21-13-19-15-26-24(17-7-5-4-6-8-17)23(20(19)14-22(21)29-2)16-9-11-18(12-10-16)25(27)30-3/h4-15H,1-3H3