4-(4-carboxyphenyl)-3-nitro-benzoic acid

Systemtic Name: 4-(4-carboxyphenyl)-3-nitro-benzoic acid Openeye Name: 4-(4-carboxyphenyl)-3-nitro-benzoic acid CAS Name: 4-(4-carboxyphenyl)-3-nitrobenzoic acid IUPAC Name: 4-(4-carboxyphenyl)-3-nitrobenzoic acid Traditional Name: 4-(4-carboxyphenyl)-3-nitro-benzoic acid Formula: C14H9NO6 MolecularWeight: 287.22436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=C(C=C(C=C2)C(=O)O)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H9NO6/c16-13(17)9-3-1-8(2-4-9)11-6-5-10(14(18)19)7-12(11)15(20)21/h1-7H,(H,16,17)(H,18,19)