2-[2-nitro-4-(phenylcarbonyl)phenyl]propanedioic acid

Systemtic Name: 2-[2-nitro-4-(phenylcarbonyl)phenyl]propanedioic acid Openeye Name: 2-(4-benzoyl-2-nitro-phenyl)propanedioic acid CAS Name: 2-(4-benzoyl-2-nitrophenyl)propanedioic acid IUPAC Name: 2-(4-benzoyl-2-nitrophenyl)propanedioic acid Traditional Name: 2-(4-benzoyl-2-nitro-phenyl)malonic acid Formula: C16H11NO7 MolecularWeight: 329.26104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11NO7/c18-14(9-4-2-1-3-5-9)10-6-7-11(12(8-10)17(23)24)13(15(19)20)16(21)22/h1-8,13H,(H,19,20)(H,21,22)