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1-iodanyl-4-octadecoxy-2-(phenylmethyl)benzene

1-iodanyl-4-octadecoxy-2-(phenylmethyl)benzene

Systemtic Name:1-iodanyl-4-octadecoxy-2-(phenylmethyl)benzene
Openeye Name:2-benzyl-1-iodo-4-octadecoxy-benzene
CAS Name:1-iodo-4-octadecoxy-2-(phenylmethyl)benzene
IUPAC Name:2-benzyl-1-iodo-4-octadecoxybenzene
Traditional Name:2-benzyl-1-iodo-4-stearyloxy-benzene
Formula: C31H47IO
MolecularWeight: 562.60875
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)I)CC2=CC=CC=C2


Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)I)CC2=CC=CC=C2


InChI

InChI=1S/C31H47IO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-25-33-30-23-24-31(32)29(27-30)26-28-21-18-17-19-22-28/h17-19,21-24,27H,2-16,20,25-26H2,1H3


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