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4-[(4-carboxy-2-nitro-phenyl)methyl]-3-nitro-benzoic acid

4-[(4-carboxy-2-nitro-phenyl)methyl]-3-nitro-benzoic acid

Systemtic Name:4-[(4-carboxy-2-nitro-phenyl)methyl]-3-nitro-benzoic acid
Openeye Name:4-[(4-carboxy-2-nitro-phenyl)methyl]-3-nitro-benzoic acid
CAS Name:4-[(4-carboxy-2-nitrophenyl)methyl]-3-nitrobenzoic acid
IUPAC Name:4-[(4-carboxy-2-nitrophenyl)methyl]-3-nitrobenzoic acid
Traditional Name:4-(4-carboxy-2-nitro-benzyl)-3-nitro-benzoic acid
Formula: C15H10N2O8
MolecularWeight: 346.2485
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])CC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]


Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])CC2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-]


InChI

InChI=1S/C15H10N2O8/c18-14(19)10-3-1-8(12(6-10)16(22)23)5-9-2-4-11(15(20)21)7-13(9)17(24)25/h1-4,6-7H,5H2,(H,18,19)(H,20,21)


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