2-[1-[3,5-di(propan-2-yloxy)phenyl]-7-methoxy-6-propan-2-yloxy-isoquinolin-4-yl]ethanoic acid

Systemtic Name: 2-[1-[3,5-di(propan-2-yloxy)phenyl]-7-methoxy-6-propan-2-yloxy-isoquinolin-4-yl]ethanoic acid Openeye Name: 2-[1-(3,5-diisopropoxyphenyl)-6-isopropoxy-7-methoxy-4-isoquinolyl]acetic acid CAS Name: 2-[1-[3,5-di(propan-2-yloxy)phenyl]-7-methoxy-6-propan-2-yloxy-4-isoquinolinyl]acetic acid IUPAC Name: 2-[1-[3,5-di(propan-2-yloxy)phenyl]-7-methoxy-6-propan-2-yloxyisoquinolin-4-yl]acetic acid Traditional Name: 2-[1-(3,5-diisopropoxyphenyl)-6-isopropoxy-7-methoxy-4-isoquinolyl]acetic acid Formula: C27H33NO6 MolecularWeight: 467.55402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H33NO6/c1-15(2)32-20-8-18(9-21(11-20)33-16(3)4)27-23-13-24(31-7)25(34-17(5)6)12-22(23)19(14-28-27)10-26(29)30/h8-9,11-17H,10H2,1-7H3,(H,29,30)