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

Systemtic Name: 1-[4-(isoquinolin-1-ylmethyl)phenyl]pent-4-yn-2-ol Openeye Name: 1-[4-(1-isoquinolylmethyl)phenyl]pent-4-yn-2-ol CAS Name: 1-[4-(1-isoquinolinylmethyl)phenyl]-4-pentyn-2-ol IUPAC Name: 1-[4-(isoquinolin-1-ylmethyl)phenyl]pent-4-yn-2-ol Traditional Name: 1-[4-(1-isoquinolylmethyl)phenyl]pent-4-yn-2-ol Formula: C21H19NO MolecularWeight: 301.38166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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