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

Systemtic Name: 1-[4-(isoquinolin-1-ylmethyl)phenyl]-2-methyl-but-3-yn-2-ol Openeye Name: 1-[4-(1-isoquinolylmethyl)phenyl]-2-methyl-but-3-yn-2-ol CAS Name: 1-[4-(1-isoquinolinylmethyl)phenyl]-2-methyl-3-butyn-2-ol IUPAC Name: 1-[4-(isoquinolin-1-ylmethyl)phenyl]-2-methylbut-3-yn-2-ol Traditional Name: 1-[4-(1-isoquinolylmethyl)phenyl]-2-methyl-but-3-yn-2-ol Formula: C21H19NO MolecularWeight: 301.38166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19NO/c1-3-21(2,23)15-17-10-8-16(9-11-17)14-20-19-7-5-4-6-18(19)12-13-22-20/h1,4-13,23H,14-15H2,2H3