(12bS,12cS)-12b,12c-dimethyl-9,10-dihydro-8H-benzo[a]pyren-7-one

Systemtic Name: (12bS,12cS)-12b,12c-dimethyl-9,10-dihydro-8H-benzo[a]pyren-7-one Openeye Name: (12bS,12cS)-12b,12c-dimethyl-9,10-dihydro-8H-benzo[a]pyren-7-one CAS Name: (12bS,12cS)-12b,12c-dimethyl-9,10-dihydro-8H-benzo[a]pyren-7-one IUPAC Name: (12bS,12cS)-12b,12c-dimethyl-9,10-dihydro-8H-benzo[a]pyren-7-one Traditional Name: (12bS,12cS)-12b,12c-dimethyl-9,10-dihydro-8H-benzo[a]pyren-7-one Formula: C22H20O MolecularWeight: 300.3936

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Descriptors Computed from Structure

Canonical SMILES:

CC12C3=CC=C4C1(C(=C5CCCC(=O)C5=C4)C=CC2=CC=C3)C

Isomeric SMILES

C[C@@]12C3=CC=C4[C@]1(C(=C5CCCC(=O)C5=C4)C=CC2=CC=C3)C

InChI

InChI=1S/C22H20O/c1-21-14-5-3-6-15(21)11-12-19-17-7-4-8-20(23)18(17)13-16(10-9-14)22(19,21)2/h3,5-6,9-13H,4,7-8H2,1-2H3/t21-,22-/m0/s1