3-[5-[5-(3-chloranyl-4-propan-2-yloxy-phenyl)-1,2,4-oxadiazol-3-yl]isoquinolin-1-yl]propan-1-ol

Systemtic Name: 3-[5-[5-(3-chloranyl-4-propan-2-yloxy-phenyl)-1,2,4-oxadiazol-3-yl]isoquinolin-1-yl]propan-1-ol Openeye Name: 3-[5-[5-(3-chloro-4-isopropoxy-phenyl)-1,2,4-oxadiazol-3-yl]-1-isoquinolyl]propan-1-ol CAS Name: 3-[5-[5-(3-chloro-4-propan-2-yloxyphenyl)-1,2,4-oxadiazol-3-yl]-1-isoquinolinyl]-1-propanol IUPAC Name: 3-[5-[5-(3-chloro-4-propan-2-yloxyphenyl)-1,2,4-oxadiazol-3-yl]isoquinolin-1-yl]propan-1-ol Traditional Name: 3-[5-[5-(3-chloro-4-isopropoxy-phenyl)-1,2,4-oxadiazol-3-yl]-1-isoquinolyl]propan-1-ol Formula: C23H22ClN3O3 MolecularWeight: 423.89208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C2=NC(=NO2)C3=CC=CC4=C3C=CN=C4CCCO)Cl

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C2=NC(=NO2)C3=CC=CC4=C3C=CN=C4CCCO)Cl

InChI

InChI=1S/C23H22ClN3O3/c1-14(2)29-21-9-8-15(13-19(21)24)23-26-22(27-30-23)18-6-3-5-17-16(18)10-11-25-20(17)7-4-12-28/h3,5-6,8-11,13-14,28H,4,7,12H2,1-2H3