2,3,3a,12c-tetrahydro-1H-benzo[a]pyren-4-one

Systemtic Name: 2,3,3a,12c-tetrahydro-1H-benzo[a]pyren-4-one Openeye Name: 2,3,3a,12c-tetrahydro-1H-benzo[a]pyren-4-one CAS Name: 2,3,3a,12c-tetrahydro-1H-benzo[a]pyren-4-one IUPAC Name: 2,3,3a,12c-tetrahydro-1H-benzo[a]pyren-4-one Traditional Name: 2,3,3a,12c-tetrahydro-1H-benzo[a]pyren-4-one Formula: C20H16O MolecularWeight: 272.34044

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(=O)C=C3C=C4C=CC=CC4=C5C3C2=C(C1)C=C5

Isomeric SMILES

C1CC2C(=O)C=C3C=C4C=CC=CC4=C5C3C2=C(C1)C=C5

InChI

InChI=1S/C20H16O/c21-18-11-14-10-13-4-1-2-6-15(13)16-9-8-12-5-3-7-17(18)19(12)20(14)16/h1-2,4,6,8-11,17,20H,3,5,7H2