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1-(2,4,6-trinitrophenyl)propan-2-one

1-(2,4,6-trinitrophenyl)propan-2-one

Systemtic Name:1-(2,4,6-trinitrophenyl)propan-2-one
Openeye Name:1-(2,4,6-trinitrophenyl)propan-2-one
CAS Name:1-(2,4,6-trinitrophenyl)-2-propanone
IUPAC Name:1-(2,4,6-trinitrophenyl)propan-2-one
Traditional Name:1-picrylacetone
Formula: C9H7N3O7
MolecularWeight: 269.16778
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

CC(=O)CC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C9H7N3O7/c1-5(13)2-7-8(11(16)17)3-6(10(14)15)4-9(7)12(18)19/h3-4H,2H2,1H3


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