methyl 2-[1-(2-fluoranyl-5-propan-2-yloxy-phenyl)carbonyl-6,7-dimethoxy-isoquinolin-4-yl]propanoate

Systemtic Name: methyl 2-[1-(2-fluoranyl-5-propan-2-yloxy-phenyl)carbonyl-6,7-dimethoxy-isoquinolin-4-yl]propanoate Openeye Name: methyl 2-[1-(2-fluoro-5-isopropoxy-benzoyl)-6,7-dimethoxy-4-isoquinolyl]propanoate CAS Name: 2-[1-[(2-fluoro-5-propan-2-yloxyphenyl)-oxomethyl]-6,7-dimethoxy-4-isoquinolinyl]propanoic acid methyl ester IUPAC Name: methyl 2-[1-(2-fluoro-5-propan-2-yloxybenzoyl)-6,7-dimethoxyisoquinolin-4-yl]propanoate Traditional Name: 2-[1-(2-fluoro-5-isopropoxy-benzoyl)-6,7-dimethoxy-4-isoquinolyl]propionic acid methyl ester Formula: C25H26FNO6 MolecularWeight: 455.475443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC(=C(C=C1)F)C(=O)C2=NC=C(C3=CC(=C(C=C32)OC)OC)C(C)C(=O)OC

Isomeric SMILES

CC(C)OC1=CC(=C(C=C1)F)C(=O)C2=NC=C(C3=CC(=C(C=C32)OC)OC)C(C)C(=O)OC

InChI

InChI=1S/C25H26FNO6/c1-13(2)33-15-7-8-20(26)18(9-15)24(28)23-17-11-22(31-5)21(30-4)10-16(17)19(12-27-23)14(3)25(29)32-6/h7-14H,1-6H3