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4,5,7-trimethylbenzo[a]pyrene

4,5,7-trimethylbenzo[a]pyrene

Systemtic Name:4,5,7-trimethylbenzo[a]pyrene
Openeye Name:4,5,7-trimethylbenzo[a]pyrene
CAS Name:4,5,7-trimethylbenzo[a]pyrene
IUPAC Name:4,5,7-trimethylbenzo[a]pyrene
Traditional Name:4,5,7-trimethylbenzo[a]pyrene
Formula: C23H18
MolecularWeight: 294.38902
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C3C=CC4=C5C3=C(C=C12)C(=C(C5=CC=C4)C)C


Isomeric SMILES

CC1=CC=CC2=C3C=CC4=C5C3=C(C=C12)C(=C(C5=CC=C4)C)C


InChI

InChI=1S/C23H18/c1-13-6-4-9-18-19-11-10-16-7-5-8-17-14(2)15(3)21(12-20(13)18)23(19)22(16)17/h4-12H,1-3H3


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