7,8-dimethylbenzo[a]pyrene

Systemtic Name: 7,8-dimethylbenzo[a]pyrene Openeye Name: 7,8-dimethylbenzo[a]pyrene CAS Name: 7,8-dimethylbenzo[a]pyrene IUPAC Name: 7,8-dimethylbenzo[a]pyrene Traditional Name: 7,8-dimethylbenzo[a]pyrene Formula: C22H16 MolecularWeight: 280.36244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C3=C4C(=C2)C=CC5=C4C(=CC=C5)C=C3)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C3=C4C(=C2)C=CC5=C4C(=CC=C5)C=C3)C

InChI

InChI=1S/C22H16/c1-13-6-10-18-19-11-9-16-5-3-4-15-7-8-17(22(19)21(15)16)12-20(18)14(13)2/h3-12H,1-2H3