(12cR,12dR)-12c,12d-dimethylbenzo[e]pyrene

Systemtic Name: (12cR,12dR)-12c,12d-dimethylbenzo[e]pyrene Openeye Name: (12cR,12dR)-12c,12d-dimethylbenzo[e]pyrene CAS Name: (12cR,12dR)-12c,12d-dimethylbenzo[e]pyrene IUPAC Name: (12cR,12dR)-12c,12d-dimethylbenzo[e]pyrene Traditional Name: (12cR,12dR)-12c,12d-dimethylbenzo[e]pyrene Formula: C22H18 MolecularWeight: 282.37832

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Descriptors Computed from Structure

Canonical SMILES:

CC12C3=CC=C4C1(C(=CC=C4)C5=CC=CC=C5C2=CC=C3)C

Isomeric SMILES

C[C@]12C3=CC=C4[C@@]1(C(=CC=C4)C5=CC=CC=C5C2=CC=C3)C

InChI

InChI=1S/C22H18/c1-21-15-7-5-11-19(21)17-9-3-4-10-18(17)20-12-6-8-16(14-13-15)22(20,21)2/h3-14H,1-2H3/t21-,22-/m1/s1