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2-[4-bromanyl-2-(diphenylphosphorylmethyl)phenoxy]ethanenitrile

2-[4-bromanyl-2-(diphenylphosphorylmethyl)phenoxy]ethanenitrile

Systemtic Name:2-[4-bromanyl-2-(diphenylphosphorylmethyl)phenoxy]ethanenitrile
Openeye Name:2-[4-bromo-2-(diphenylphosphorylmethyl)phenoxy]acetonitrile
CAS Name:2-[4-bromo-2-(diphenylphosphorylmethyl)phenoxy]acetonitrile
IUPAC Name:2-[4-bromo-2-(diphenylphosphorylmethyl)phenoxy]acetonitrile
Traditional Name:2-[4-bromo-2-(diphenylphosphorylmethyl)phenoxy]acetonitrile
Formula: C21H17BrNO2P
MolecularWeight: 426.242941
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(=O)(CC2=C(C=CC(=C2)Br)OCC#N)C3=CC=CC=C3


Isomeric SMILES

C1=CC=C(C=C1)P(=O)(CC2=C(C=CC(=C2)Br)OCC#N)C3=CC=CC=C3


InChI

InChI=1S/C21H17BrNO2P/c22-18-11-12-21(25-14-13-23)17(15-18)16-26(24,19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-12,15H,14,16H2


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