1-[4-(isoquinolin-1-ylmethyl)phenyl]but-3-yn-2-ol

Systemtic Name: 1-[4-(isoquinolin-1-ylmethyl)phenyl]but-3-yn-2-ol Openeye Name: 1-[4-(1-isoquinolylmethyl)phenyl]but-3-yn-2-ol CAS Name: 1-[4-(1-isoquinolinylmethyl)phenyl]-3-butyn-2-ol IUPAC Name: 1-[4-(isoquinolin-1-ylmethyl)phenyl]but-3-yn-2-ol Traditional Name: 1-[4-(1-isoquinolylmethyl)phenyl]but-3-yn-2-ol Formula: C20H17NO MolecularWeight: 287.35508

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Descriptors Computed from Structure

Canonical SMILES:

C#CC(CC1=CC=C(C=C1)CC2=NC=CC3=CC=CC=C32)O

Isomeric SMILES

C#CC(CC1=CC=C(C=C1)CC2=NC=CC3=CC=CC=C32)O

InChI

InChI=1S/C20H17NO/c1-2-18(22)13-15-7-9-16(10-8-15)14-20-19-6-4-3-5-17(19)11-12-21-20/h1,3-12,18,22H,13-14H2