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4-nitro-1-phenyl-octan-3-one

4-nitro-1-phenyl-octan-3-one

Systemtic Name:4-nitro-1-phenyl-octan-3-one
Openeye Name:4-nitro-1-phenyl-octan-3-one
CAS Name:4-nitro-1-phenyl-3-octanone
IUPAC Name:4-nitro-1-phenyloctan-3-one
Traditional Name:4-nitro-1-phenyl-octan-3-one
Formula: C14H19NO3
MolecularWeight: 249.30556
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)CCC1=CC=CC=C1)[N+](=O)[O-]


Isomeric SMILES

CCCCC(C(=O)CCC1=CC=CC=C1)[N+](=O)[O-]


InChI

InChI=1S/C14H19NO3/c1-2-3-9-13(15(17)18)14(16)11-10-12-7-5-4-6-8-12/h4-8,13H,2-3,9-11H2,1H3


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