12aH-benzo[a]pyrene-1,3-dione

Systemtic Name: 12aH-benzo[a]pyrene-1,3-dione Openeye Name: 12aH-benzo[a]pyrene-1,3-dione CAS Name: 12aH-benzo[a]pyrene-1,3-dione IUPAC Name: 12aH-benzo[a]pyrene-1,3-dione Traditional Name: 12aH-benzo[a]pyrene-1,3-quinone Formula: C20H12O2 MolecularWeight: 284.30808

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C2C=CC3=C4C2=C(C1=O)C=CC4=CC5=CC=CC=C35

Isomeric SMILES

C1C(=O)C2C=CC3=C4C2=C(C1=O)C=CC4=CC5=CC=CC=C35

InChI

InChI=1S/C20H12O2/c21-17-10-18(22)16-8-7-14-13-4-2-1-3-11(13)9-12-5-6-15(17)20(16)19(12)14/h1-9,16H,10H2