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1-[4-nitro-2-(phenylcarbonyl)phenyl]pyrazole-3,5-dicarboxylic acid

1-[4-nitro-2-(phenylcarbonyl)phenyl]pyrazole-3,5-dicarboxylic acid

Systemtic Name:1-[4-nitro-2-(phenylcarbonyl)phenyl]pyrazole-3,5-dicarboxylic acid
Openeye Name:1-(2-benzoyl-4-nitro-phenyl)pyrazole-3,5-dicarboxylic acid
CAS Name:1-(2-benzoyl-4-nitrophenyl)pyrazole-3,5-dicarboxylic acid
IUPAC Name:1-(2-benzoyl-4-nitrophenyl)pyrazole-3,5-dicarboxylic acid
Traditional Name:1-(2-benzoyl-4-nitro-phenyl)pyrazole-3,5-dicarboxylic acid
Formula: C18H11N3O7
MolecularWeight: 381.29584
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3C(=CC(=N3)C(=O)O)C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3C(=CC(=N3)C(=O)O)C(=O)O


InChI

InChI=1S/C18H11N3O7/c22-16(10-4-2-1-3-5-10)12-8-11(21(27)28)6-7-14(12)20-15(18(25)26)9-13(19-20)17(23)24/h1-9H,(H,23,24)(H,25,26)


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