5-[(4-aminophenyl)carbonylamino]-2-phenylazanyl-benzenesulfonic acid

Systemtic Name: 5-[(4-aminophenyl)carbonylamino]-2-phenylazanyl-benzenesulfonic acid Openeye Name: 5-[(4-aminobenzoyl)amino]-2-anilino-benzenesulfonic acid CAS Name: 5-[[(4-aminophenyl)-oxomethyl]amino]-2-anilinobenzenesulfonic acid IUPAC Name: 5-[(4-aminobenzoyl)amino]-2-anilinobenzenesulfonic acid Traditional Name: 5-[(4-aminobenzoyl)amino]-2-anilino-besylic acid Formula: C19H17N3O4S MolecularWeight: 383.42098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)N)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)N)S(=O)(=O)O

InChI

InChI=1S/C19H17N3O4S/c20-14-8-6-13(7-9-14)19(23)22-16-10-11-17(18(12-16)27(24,25)26)21-15-4-2-1-3-5-15/h1-12,21H,20H2,(H,22,23)(H,24,25,26)