4-[(3-aminophenyl)carbonylamino]-3-chloranyl-benzenesulfonic acid

Systemtic Name: 4-[(3-aminophenyl)carbonylamino]-3-chloranyl-benzenesulfonic acid Openeye Name: 4-[(3-aminobenzoyl)amino]-3-chloro-benzenesulfonic acid CAS Name: 4-[[(3-aminophenyl)-oxomethyl]amino]-3-chlorobenzenesulfonic acid IUPAC Name: 4-[(3-aminobenzoyl)amino]-3-chlorobenzenesulfonic acid Traditional Name: 4-[(3-aminobenzoyl)amino]-3-chloro-besylic acid Formula: C13H11ClN2O4S MolecularWeight: 326.75544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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