1-[2-(1,3-benzodioxol-5-yl)phenyl]prop-2-yn-1-ol

Systemtic Name: 1-[2-(1,3-benzodioxol-5-yl)phenyl]prop-2-yn-1-ol Openeye Name: 1-[2-(1,3-benzodioxol-5-yl)phenyl]prop-2-yn-1-ol CAS Name: 1-[2-(1,3-benzodioxol-5-yl)phenyl]-2-propyn-1-ol IUPAC Name: 1-[2-(1,3-benzodioxol-5-yl)phenyl]prop-2-yn-1-ol Traditional Name: 1-[2-(1,3-benzodioxol-5-yl)phenyl]prop-2-yn-1-ol Formula: C16H12O3 MolecularWeight: 252.26468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CC(C1=CC=CC=C1C2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

C#CC(C1=CC=CC=C1C2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C16H12O3/c1-2-14(17)13-6-4-3-5-12(13)11-7-8-15-16(9-11)19-10-18-15/h1,3-9,14,17H,10H2