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5-nitro-2-propanoyl-phenolate

5-nitro-2-propanoyl-phenolate

Systemtic Name:5-nitro-2-propanoyl-phenolate
Openeye Name:5-nitro-2-propanoyl-phenolate
CAS Name:5-nitro-2-(1-oxopropyl)phenolate
IUPAC Name:5-nitro-2-propanoylphenolate
Traditional Name:5-nitro-2-propionyl-phenolate
Formula: C9H8NO4-
MolecularWeight: 194.16412
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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])[O-]


Isomeric SMILES

CCC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])[O-]


InChI

InChI=1S/C9H9NO4/c1-2-8(11)7-4-3-6(10(13)14)5-9(7)12/h3-5,12H,2H2,1H3/p-1


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