benzo[a]pyrene-3,5-diol

Systemtic Name: benzo[a]pyrene-3,5-diol Openeye Name: benzo[a]pyrene-3,5-diol CAS Name: benzo[a]pyrene-3,5-diol IUPAC Name: benzo[a]pyrene-3,5-diol Traditional Name: benzo[a]pyrene-3,5-diol Formula: C20H12O2 MolecularWeight: 284.30808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C3=C4C(=CC2=C1)C(=CC5=C(C=CC(=C54)C=C3)O)O

Isomeric SMILES

C1=CC=C2C3=C4C(=CC2=C1)C(=CC5=C(C=CC(=C54)C=C3)O)O

InChI

InChI=1S/C20H12O2/c21-17-8-6-11-5-7-14-13-4-2-1-3-12(13)9-15-18(22)10-16(17)19(11)20(14)15/h1-10,21-22H