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(12bS,12cS)-12b,12c-dimethylbenzo[a]pyrene

(12bS,12cS)-12b,12c-dimethylbenzo[a]pyrene

Systemtic Name:(12bS,12cS)-12b,12c-dimethylbenzo[a]pyrene
Openeye Name:(12bS,12cS)-12b,12c-dimethylbenzo[a]pyrene
CAS Name:(12bS,12cS)-12b,12c-dimethylbenzo[a]pyrene
IUPAC Name:(12bS,12cS)-12b,12c-dimethylbenzo[a]pyrene
Traditional Name:(12bS,12cS)-12b,12c-dimethylbenzo[a]pyrene
Formula: C22H18
MolecularWeight: 282.37832
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Descriptors Computed from Structure

Canonical SMILES:

CC12C3=CC=C4C1(C(=CC5=CC=CC=C54)C=CC2=CC=C3)C


Isomeric SMILES

C[C@]12C3=CC=C4[C@@]1(C(=CC5=CC=CC=C54)C=CC2=CC=C3)C


InChI

InChI=1S/C22H18/c1-21-16-7-5-8-17(21)12-13-20-19-9-4-3-6-15(19)14-18(11-10-16)22(20,21)2/h3-14H,1-2H3/t21-,22-/m0/s1


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