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3,7,8-trimethoxybenzo[a]pyrene

3,7,8-trimethoxybenzo[a]pyrene

Systemtic Name:3,7,8-trimethoxybenzo[a]pyrene
Openeye Name:3,7,8-trimethoxybenzo[a]pyrene
CAS Name:3,7,8-trimethoxybenzo[a]pyrene
IUPAC Name:3,7,8-trimethoxybenzo[a]pyrene
Traditional Name:3,7,8-trimethoxybenzo[a]pyrene
Formula: C23H18O3
MolecularWeight: 342.38722
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C=CC3=CC4=C(C=CC(=C4OC)OC)C5=C3C2=C(C=C5)C=C1


Isomeric SMILES

COC1=C2C=CC3=CC4=C(C=CC(=C4OC)OC)C5=C3C2=C(C=C5)C=C1


InChI

InChI=1S/C23H18O3/c1-24-19-10-6-13-4-7-16-15-9-11-20(25-2)23(26-3)18(15)12-14-5-8-17(19)21(13)22(14)16/h4-12H,1-3H3


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