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2-(chloromethyl)benzo[a]pyrene

2-(chloromethyl)benzo[a]pyrene

Systemtic Name:2-(chloromethyl)benzo[a]pyrene
Openeye Name:2-(chloromethyl)benzo[a]pyrene
CAS Name:2-(chloromethyl)benzo[a]pyrene
IUPAC Name:2-(chloromethyl)benzo[a]pyrene
Traditional Name:2-(chloromethyl)benzo[a]pyrene
Formula: C21H13Cl
MolecularWeight: 300.78092
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C3=C4C(=CC2=C1)C=CC5=CC(=CC(=C54)C=C3)CCl


Isomeric SMILES

C1=CC=C2C3=C4C(=CC2=C1)C=CC5=CC(=CC(=C54)C=C3)CCl


InChI

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


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