4-[2-chloranyl-6-[(3-nitrophenyl)carbonylamino]phenoxy]benzenesulfonic acid

Systemtic Name: 4-[2-chloranyl-6-[(3-nitrophenyl)carbonylamino]phenoxy]benzenesulfonic acid Openeye Name: 4-[2-chloro-6-[(3-nitrobenzoyl)amino]phenoxy]benzenesulfonic acid CAS Name: 4-[2-chloro-6-[[(3-nitrophenyl)-oxomethyl]amino]phenoxy]benzenesulfonic acid IUPAC Name: 4-[2-chloro-6-[(3-nitrobenzoyl)amino]phenoxy]benzenesulfonic acid Traditional Name: 4-[2-chloro-6-[(3-nitrobenzoyl)amino]phenoxy]besylic acid Formula: C19H13ClN2O7S MolecularWeight: 448.83372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=C(C(=CC=C2)Cl)OC3=CC=C(C=C3)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=C(C(=CC=C2)Cl)OC3=CC=C(C=C3)S(=O)(=O)O

InChI

InChI=1S/C19H13ClN2O7S/c20-16-5-2-6-17(21-19(23)12-3-1-4-13(11-12)22(24)25)18(16)29-14-7-9-15(10-8-14)30(26,27)28/h1-11H,(H,21,23)(H,26,27,28)