2-[(2-chloranyl-4-iodanyl-phenyl)amino]-4-nitro-benzenesulfonic acid

Systemtic Name: 2-[(2-chloranyl-4-iodanyl-phenyl)amino]-4-nitro-benzenesulfonic acid Openeye Name: 2-(2-chloro-4-iodo-anilino)-4-nitro-benzenesulfonic acid CAS Name: 2-(2-chloro-4-iodoanilino)-4-nitrobenzenesulfonic acid IUPAC Name: 2-(2-chloro-4-iodoanilino)-4-nitrobenzenesulfonic acid Traditional Name: 2-(2-chloro-4-iodo-anilino)-4-nitro-besylic acid Formula: C12H8ClIN2O5S MolecularWeight: 454.62479

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])NC2=C(C=C(C=C2)I)Cl)S(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])NC2=C(C=C(C=C2)I)Cl)S(=O)(=O)O

InChI

InChI=1S/C12H8ClIN2O5S/c13-9-5-7(14)1-3-10(9)15-11-6-8(16(17)18)2-4-12(11)22(19,20)21/h1-6,15H,(H,19,20,21)