5-[(4-nitrophenyl)sulfonylmethyl]furan-2-carboxylic acid

Systemtic Name: 5-[(4-nitrophenyl)sulfonylmethyl]furan-2-carboxylic acid Openeye Name: 5-[(4-nitrophenyl)sulfonylmethyl]furan-2-carboxylic acid CAS Name: 5-[(4-nitrophenyl)sulfonylmethyl]-2-furancarboxylic acid IUPAC Name: 5-[(4-nitrophenyl)sulfonylmethyl]furan-2-carboxylic acid Traditional Name: 5-(nosylmethyl)-2-furoic acid Formula: C12H9NO7S MolecularWeight: 311.26736

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)CC2=CC=C(O2)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)CC2=CC=C(O2)C(=O)O

InChI

InChI=1S/C12H9NO7S/c14-12(15)11-6-3-9(20-11)7-21(18,19)10-4-1-8(2-5-10)13(16)17/h1-6H,7H2,(H,14,15)