3-chloranyl-2-nitro-benzenesulfonic acid

Systemtic Name: 3-chloranyl-2-nitro-benzenesulfonic acid Openeye Name: 3-chloro-2-nitro-benzenesulfonic acid CAS Name: 3-chloro-2-nitrobenzenesulfonic acid IUPAC Name: 3-chloro-2-nitrobenzenesulfonic acid Traditional Name: 3-chloro-2-nitro-besylic acid Formula: C6H4ClNO5S MolecularWeight: 237.61766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H4ClNO5S/c7-4-2-1-3-5(14(11,12)13)6(4)8(9)10/h1-3H,(H,11,12,13)