4-[[azanyl-(4-chlorophenyl)carbamoyl]amino]benzenesulfonic acid

Systemtic Name: 4-[[azanyl-(4-chlorophenyl)carbamoyl]amino]benzenesulfonic acid Openeye Name: 4-[[amino-(4-chlorophenyl)carbamoyl]amino]benzenesulfonic acid CAS Name: 4-[[(N-amino-4-chloroanilino)-oxomethyl]amino]benzenesulfonic acid IUPAC Name: 4-[[amino-(4-chlorophenyl)carbamoyl]amino]benzenesulfonic acid Traditional Name: 4-[[amino-(4-chlorophenyl)carbamoyl]amino]besylic acid Formula: C13H12ClN3O4S MolecularWeight: 341.77008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)N(C2=CC=C(C=C2)Cl)N)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1NC(=O)N(C2=CC=C(C=C2)Cl)N)S(=O)(=O)O

InChI

InChI=1S/C13H12ClN3O4S/c14-9-1-5-11(6-2-9)17(15)13(18)16-10-3-7-12(8-4-10)22(19,20)21/h1-8H,15H2,(H,16,18)(H,19,20,21)