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benzo[a]pyrene-3,6-dione

benzo[a]pyrene-3,6-dione

Systemtic Name:benzo[a]pyrene-3,6-dione
Openeye Name:benzo[a]pyrene-3,6-dione
CAS Name:benzo[a]pyrene-3,6-dione
IUPAC Name:benzo[a]pyrene-3,6-dione
Traditional Name:benzo[a]pyrene-3,6-quinone
Formula: C20H10O2
MolecularWeight: 282.2922
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C=CC5=O)C2=O


Isomeric SMILES

C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C=CC5=O)C2=O


InChI

InChI=1S/C20H10O2/c21-17-10-6-11-5-7-13-12-3-1-2-4-14(12)20(22)16-9-8-15(17)18(11)19(13)16/h1-10H


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