1-pyren-1-ylethane-1,2-diol

Systemtic Name: 1-pyren-1-ylethane-1,2-diol Openeye Name: 1-pyren-1-ylethane-1,2-diol CAS Name: 1-(1-pyrenyl)ethane-1,2-diol IUPAC Name: 1-pyren-1-ylethane-1,2-diol Traditional Name: 1-pyren-1-ylethane-1,2-diol Formula: C18H14O2 MolecularWeight: 262.30256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C(CO)O

Isomeric SMILES

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C(CO)O

InChI

InChI=1S/C18H14O2/c19-10-16(20)14-8-6-13-5-4-11-2-1-3-12-7-9-15(14)18(13)17(11)12/h1-9,16,19-20H,10H2