3-[3,6,8-tris(3-oxidanylprop-1-ynyl)pyren-1-yl]prop-2-yn-1-ol

Systemtic Name: 3-[3,6,8-tris(3-oxidanylprop-1-ynyl)pyren-1-yl]prop-2-yn-1-ol Openeye Name: 3-[3,6,8-tris(3-hydroxyprop-1-ynyl)pyren-1-yl]prop-2-yn-1-ol CAS Name: 3-[3,6,8-tris(3-hydroxyprop-1-ynyl)-1-pyrenyl]-2-propyn-1-ol IUPAC Name: 3-[3,6,8-tris(3-hydroxyprop-1-ynyl)pyren-1-yl]prop-2-yn-1-ol Traditional Name: 3-[3,6,8-tris(3-hydroxyprop-1-ynyl)pyren-1-yl]prop-2-yn-1-ol Formula: C28H18O4 MolecularWeight: 418.44012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C(C=C2C#CCO)C#CCO)C=CC4=C(C=C(C1=C43)C#CCO)C#CCO

Isomeric SMILES

C1=CC2=C3C(=C(C=C2C#CCO)C#CCO)C=CC4=C(C=C(C1=C43)C#CCO)C#CCO

InChI

InChI=1S/C28H18O4/c29-13-1-5-19-17-20(6-2-14-30)24-11-12-26-22(8-4-16-32)18-21(7-3-15-31)25-10-9-23(19)27(24)28(25)26/h9-12,17-18,29-32H,13-16H2