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3-[(4-nitrophenyl)methyl]pentanedinitrile

3-[(4-nitrophenyl)methyl]pentanedinitrile

Systemtic Name:3-[(4-nitrophenyl)methyl]pentanedinitrile
Openeye Name:3-[(4-nitrophenyl)methyl]pentanedinitrile
CAS Name:3-[(4-nitrophenyl)methyl]pentanedinitrile
IUPAC Name:3-[(4-nitrophenyl)methyl]pentanedinitrile
Traditional Name:3-(4-nitrobenzyl)glutaronitrile
Formula: C12H11N3O2
MolecularWeight: 229.23464
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(CC#N)CC#N)[N+](=O)[O-]


Isomeric SMILES

C1=CC(=CC=C1CC(CC#N)CC#N)[N+](=O)[O-]


InChI

InChI=1S/C12H11N3O2/c13-7-5-11(6-8-14)9-10-1-3-12(4-2-10)15(16)17/h1-4,11H,5-6,9H2


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