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7-(chloromethyl)benzo[a]pyrene

7-(chloromethyl)benzo[a]pyrene

Systemtic Name:7-(chloromethyl)benzo[a]pyrene
Openeye Name:7-(chloromethyl)benzo[a]pyrene
CAS Name:7-(chloromethyl)benzo[a]pyrene
IUPAC Name:7-(chloromethyl)benzo[a]pyrene
Traditional Name:7-(chloromethyl)benzo[a]pyrene
Formula: C21H13Cl
MolecularWeight: 300.78092
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4C=CC=C5CCl)C=C2


Isomeric SMILES

C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4C=CC=C5CCl)C=C2


InChI

InChI=1S/C21H13Cl/c22-12-16-5-2-6-17-18-10-9-14-4-1-3-13-7-8-15(11-19(16)17)21(18)20(13)14/h1-11H,12H2


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