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4-[6-(chloromethyl)pyren-1-yl]benzenecarbonitrile

4-[6-(chloromethyl)pyren-1-yl]benzenecarbonitrile

Systemtic Name:4-[6-(chloromethyl)pyren-1-yl]benzenecarbonitrile
Openeye Name:4-[6-(chloromethyl)pyren-1-yl]benzonitrile
CAS Name:4-[6-(chloromethyl)-1-pyrenyl]benzonitrile
IUPAC Name:4-[6-(chloromethyl)pyren-1-yl]benzonitrile
Traditional Name:4-[6-(chloromethyl)pyren-1-yl]benzonitrile
Formula: C24H14ClN
MolecularWeight: 351.82766
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=CC3=C4C2=C1C=CC4=C(C=C3)C5=CC=C(C=C5)C#N)CCl


Isomeric SMILES

C1=CC(=C2C=CC3=C4C2=C1C=CC4=C(C=C3)C5=CC=C(C=C5)C#N)CCl


InChI

InChI=1S/C24H14ClN/c25-13-19-6-5-17-9-12-22-20(16-3-1-15(14-26)2-4-16)10-7-18-8-11-21(19)23(17)24(18)22/h1-12H,13H2


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