3-[(2-azanyl-5-chloranyl-phenyl)carbamoyl]benzenesulfonic acid

Systemtic Name: 3-[(2-azanyl-5-chloranyl-phenyl)carbamoyl]benzenesulfonic acid Openeye Name: 3-[(2-amino-5-chloro-phenyl)carbamoyl]benzenesulfonic acid CAS Name: 3-[(2-amino-5-chloroanilino)-oxomethyl]benzenesulfonic acid IUPAC Name: 3-[(2-amino-5-chlorophenyl)carbamoyl]benzenesulfonic acid Traditional Name: 3-[(2-amino-5-chloro-phenyl)carbamoyl]besylic acid Formula: C13H11ClN2O4S MolecularWeight: 326.75544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11ClN2O4S/c14-9-4-5-11(15)12(7-9)16-13(17)8-2-1-3-10(6-8)21(18,19)20/h1-7H,15H2,(H,16,17)(H,18,19,20)