2-azanyl-4-[(3,4-dichlorophenyl)carbonylamino]benzenesulfonic acid

Systemtic Name: 2-azanyl-4-[(3,4-dichlorophenyl)carbonylamino]benzenesulfonic acid Openeye Name: 2-amino-4-[(3,4-dichlorobenzoyl)amino]benzenesulfonic acid CAS Name: 2-amino-4-[[(3,4-dichlorophenyl)-oxomethyl]amino]benzenesulfonic acid IUPAC Name: 2-amino-4-[(3,4-dichlorobenzoyl)amino]benzenesulfonic acid Traditional Name: 2-amino-4-[(3,4-dichlorobenzoyl)amino]besylic acid Formula: C13H10Cl2N2O4S MolecularWeight: 361.2005

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NC2=CC(=C(C=C2)S(=O)(=O)O)N)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NC2=CC(=C(C=C2)S(=O)(=O)O)N)Cl)Cl

InChI

InChI=1S/C13H10Cl2N2O4S/c14-9-3-1-7(5-10(9)15)13(18)17-8-2-4-12(11(16)6-8)22(19,20)21/h1-6H,16H2,(H,17,18)(H,19,20,21)