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1,6-dimethylbenzo[a]pyrene

1,6-dimethylbenzo[a]pyrene

Systemtic Name:1,6-dimethylbenzo[a]pyrene
Openeye Name:1,6-dimethylbenzo[a]pyrene
CAS Name:1,6-dimethylbenzo[a]pyrene
IUPAC Name:1,6-dimethylbenzo[a]pyrene
Traditional Name:1,6-dimethylbenzo[a]pyrene
Formula: C22H16
MolecularWeight: 280.36244
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC3=C4C2=C(C=C1)C=CC4=C(C5=CC=CC=C35)C


Isomeric SMILES

CC1=C2C=CC3=C4C2=C(C=C1)C=CC4=C(C5=CC=CC=C35)C


InChI

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


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