3a,5a,10,10a,12a,12b-hexahydro-1H-benzo[a]pyren-6-one

Systemtic Name: 3a,5a,10,10a,12a,12b-hexahydro-1H-benzo[a]pyren-6-one Openeye Name: 3a,5a,10,10a,12a,12b-hexahydro-1H-benzo[a]pyren-6-one CAS Name: 3a,5a,10,10a,12a,12b-hexahydro-1H-benzo[a]pyren-6-one IUPAC Name: 3a,5a,10,10a,12a,12b-hexahydro-1H-benzo[a]pyren-6-one Traditional Name: 3a,5a,10,10a,12a,12b-hexahydro-1H-benzo[a]pyren-6-one Formula: C20H18O MolecularWeight: 274.35632

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC2C=CC3C4=C(C=CC1C24)C5CC=CC=C5C3=O

Isomeric SMILES

C1C=CC2C=CC3C4=C(C=CC1C24)C5CC=CC=C5C3=O

InChI

InChI=1S/C20H18O/c21-20-16-7-2-1-6-14(16)15-10-8-12-4-3-5-13-9-11-17(20)19(15)18(12)13/h1-3,5,7-14,17-18H,4,6H2