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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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