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6-(chloromethyl)benzo[a]pyrene

6-(chloromethyl)benzo[a]pyrene

Systemtic Name:6-(chloromethyl)benzo[a]pyrene
Openeye Name:6-(chloromethyl)benzo[a]pyrene
CAS Name:6-(chloromethyl)benzo[a]pyrene
IUPAC Name:6-(chloromethyl)benzo[a]pyrene
Traditional Name:6-(chloromethyl)benzo[a]pyrene
Formula: C21H13Cl
MolecularWeight: 300.78092
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C4C(=C2CCl)C=CC5=CC=CC(=C54)C=C3


Isomeric SMILES

C1=CC=C2C(=C1)C3=C4C(=C2CCl)C=CC5=CC=CC(=C54)C=C3


InChI

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


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