3,3a,4,5,5a,6,6a,10a-octahydrobenzo[a]pyrene

Systemtic Name: 3,3a,4,5,5a,6,6a,10a-octahydrobenzo[a]pyrene Openeye Name: 3,3a,4,5,5a,6,6a,10a-octahydrobenzo[a]pyrene CAS Name: 3,3a,4,5,5a,6,6a,10a-octahydrobenzo[a]pyrene IUPAC Name: 3,3a,4,5,5a,6,6a,10a-octahydrobenzo[a]pyrene Traditional Name: 3,3a,4,5,5a,6,6a,10a-octahydrobenzo[a]pyrene Formula: C20H20 MolecularWeight: 260.3728

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC3C=CC=CC3C4=C2C5=C(C=CCC51)C=C4

Isomeric SMILES

C1CC2CC3C=CC=CC3C4=C2C5=C(C=CCC51)C=C4

InChI

InChI=1S/C20H20/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-4,6-7,10-11,13,15-17H,5,8-9,12H2