9,10-dihydrobenzo[a]pyrene-1,2-diol

Systemtic Name: 9,10-dihydrobenzo[a]pyrene-1,2-diol Openeye Name: 9,10-dihydrobenzo[a]pyrene-1,2-diol CAS Name: 9,10-dihydrobenzo[a]pyrene-1,2-diol IUPAC Name: 9,10-dihydrobenzo[a]pyrene-1,2-diol Traditional Name: 9,10-dihydrobenzo[a]pyrene-1,2-diol Formula: C20H14O2 MolecularWeight: 286.32396

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C1)C=C3C=CC4=CC(=C(C5=C4C3=C2C=C5)O)O

Isomeric SMILES

C1CC2=C(C=C1)C=C3C=CC4=CC(=C(C5=C4C3=C2C=C5)O)O

InChI

InChI=1S/C20H14O2/c21-17-10-13-6-5-12-9-11-3-1-2-4-14(11)15-7-8-16(20(17)22)19(13)18(12)15/h1,3,5-10,21-22H,2,4H2