benzo[a]pyren-2-ol

Systemtic Name: benzo[a]pyren-2-ol Openeye Name: benzo[a]pyren-2-ol CAS Name: 2-benzo[a]pyrenol IUPAC Name: benzo[a]pyren-2-ol Traditional Name: benzo[a]pyren-2-ol Formula: C20H12O MolecularWeight: 268.30868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H12O/c21-16-10-14-6-5-13-9-12-3-1-2-4-17(12)18-8-7-15(11-16)19(14)20(13)18/h1-11,21H