1-[3-[2,3-bis(fluoranyl)-4-methyl-phenyl]isoquinolin-7-yl]but-3-yn-2-ol

Systemtic Name: 1-[3-[2,3-bis(fluoranyl)-4-methyl-phenyl]isoquinolin-7-yl]but-3-yn-2-ol Openeye Name: 1-[3-(2,3-difluoro-4-methyl-phenyl)-7-isoquinolyl]but-3-yn-2-ol CAS Name: 1-[3-(2,3-difluoro-4-methylphenyl)-7-isoquinolinyl]-3-butyn-2-ol IUPAC Name: 1-[3-(2,3-difluoro-4-methylphenyl)isoquinolin-7-yl]but-3-yn-2-ol Traditional Name: 1-[3-(2,3-difluoro-4-methyl-phenyl)-7-isoquinolyl]but-3-yn-2-ol Formula: C20H15F2NO MolecularWeight: 323.336006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C2=NC=C3C=C(C=CC3=C2)CC(C#C)O)F)F

Isomeric SMILES

CC1=C(C(=C(C=C1)C2=NC=C3C=C(C=CC3=C2)CC(C#C)O)F)F

InChI

InChI=1S/C20H15F2NO/c1-3-16(24)9-13-5-6-14-10-18(23-11-15(14)8-13)17-7-4-12(2)19(21)20(17)22/h1,4-8,10-11,16,24H,9H2,2H3