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

Systemtic Name: 2-[1-[(2-fluoranyl-5-propan-2-yloxy-phenyl)methyl]-6,7-dimethoxy-isoquinolin-4-yl]ethanoic acid Openeye Name: 2-[1-[(2-fluoro-5-isopropoxy-phenyl)methyl]-6,7-dimethoxy-4-isoquinolyl]acetic acid CAS Name: 2-[1-[(2-fluoro-5-propan-2-yloxyphenyl)methyl]-6,7-dimethoxy-4-isoquinolinyl]acetic acid IUPAC Name: 2-[1-[(2-fluoro-5-propan-2-yloxyphenyl)methyl]-6,7-dimethoxyisoquinolin-4-yl]acetic acid Traditional Name: 2-[1-(2-fluoro-5-isopropoxy-benzyl)-6,7-dimethoxy-4-isoquinolyl]acetic acid Formula: C23H24FNO5 MolecularWeight: 413.438763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC(=C(C=C1)F)CC2=NC=C(C3=CC(=C(C=C32)OC)OC)CC(=O)O

Isomeric SMILES

CC(C)OC1=CC(=C(C=C1)F)CC2=NC=C(C3=CC(=C(C=C32)OC)OC)CC(=O)O

InChI

InChI=1S/C23H24FNO5/c1-13(2)30-16-5-6-19(24)14(7-16)8-20-18-11-22(29-4)21(28-3)10-17(18)15(12-25-20)9-23(26)27/h5-7,10-13H,8-9H2,1-4H3,(H,26,27)