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

Systemtic Name: 4-(3-carboxyphenyl)sulfonyl-3-nitro-benzoic acid Openeye Name: 4-(3-carboxyphenyl)sulfonyl-3-nitro-benzoic acid CAS Name: 4-(3-carboxyphenyl)sulfonyl-3-nitrobenzoic acid IUPAC Name: 4-(3-carboxyphenyl)sulfonyl-3-nitrobenzoic acid Traditional Name: 4-(3-carboxyphenyl)sulfonyl-3-nitro-benzoic acid Formula: C14H9NO8S MolecularWeight: 351.28816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9NO8S/c16-13(17)8-2-1-3-10(6-8)24(22,23)12-5-4-9(14(18)19)7-11(12)15(20)21/h1-7H,(H,16,17)(H,18,19)