2-azanyl-4-chloranyl-5-nitro-benzenesulfonic acid

Systemtic Name: 2-azanyl-4-chloranyl-5-nitro-benzenesulfonic acid Openeye Name: 2-amino-4-chloro-5-nitro-benzenesulfonic acid CAS Name: 2-amino-4-chloro-5-nitrobenzenesulfonic acid IUPAC Name: 2-amino-4-chloro-5-nitrobenzenesulfonic acid Traditional Name: 2-amino-4-chloro-5-nitro-besylic acid Formula: C6H5ClN2O5S MolecularWeight: 252.6323

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1Cl)[N+](=O)[O-])S(=O)(=O)O)N

Isomeric SMILES

C1=C(C(=CC(=C1Cl)[N+](=O)[O-])S(=O)(=O)O)N

InChI

InChI=1S/C6H5ClN2O5S/c7-3-1-4(8)6(15(12,13)14)2-5(3)9(10)11/h1-2H,8H2,(H,12,13,14)