4-(nitromethylsulfonyl)benzoic acid

Systemtic Name: 4-(nitromethylsulfonyl)benzoic acid Openeye Name: 4-(nitromethylsulfonyl)benzoic acid CAS Name: 4-(nitromethylsulfonyl)benzoic acid IUPAC Name: 4-(nitromethylsulfonyl)benzoic acid Traditional Name: 4-(nitromethylsulfonyl)benzoic acid Formula: C8H7NO6S MolecularWeight: 245.20928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H7NO6S/c10-8(11)6-1-3-7(4-2-6)16(14,15)5-9(12)13/h1-4H,5H2,(H,10,11)