2-(hydroxymethyl)-5-pyren-1-yl-oxolan-3-ol

Systemtic Name: 2-(hydroxymethyl)-5-pyren-1-yl-oxolan-3-ol Openeye Name: 2-(hydroxymethyl)-5-pyren-1-yl-tetrahydrofuran-3-ol CAS Name: 2-(hydroxymethyl)-5-(1-pyrenyl)-3-oxolanol IUPAC Name: 2-(hydroxymethyl)-5-pyren-1-yloxolan-3-ol Traditional Name: 2-methylol-5-pyren-1-yl-tetrahydrofuran-3-ol Formula: C21H18O3 MolecularWeight: 318.36582

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1C2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2)CO)O

Isomeric SMILES

C1C(C(OC1C2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2)CO)O

InChI

InChI=1S/C21H18O3/c22-11-19-17(23)10-18(24-19)15-8-6-14-5-4-12-2-1-3-13-7-9-16(15)21(14)20(12)13/h1-9,17-19,22-23H,10-11H2