2-[[3-[(4-ethylphenyl)sulfonylamino]phenyl]sulfonylamino]benzoic acid

Systemtic Name: 2-[[3-[(4-ethylphenyl)sulfonylamino]phenyl]sulfonylamino]benzoic acid Openeye Name: 2-[[3-[(4-ethylphenyl)sulfonylamino]phenyl]sulfonylamino]benzoic acid CAS Name: 2-[[3-[(4-ethylphenyl)sulfonylamino]phenyl]sulfonylamino]benzoic acid IUPAC Name: 2-[[3-[(4-ethylphenyl)sulfonylamino]phenyl]sulfonylamino]benzoic acid Traditional Name: 2-[[3-[(4-ethylphenyl)sulfonylamino]phenyl]sulfonylamino]benzoic acid Formula: C21H20N2O6S2 MolecularWeight: 460.5233

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)S(=O)(=O)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)S(=O)(=O)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C21H20N2O6S2/c1-2-15-10-12-17(13-11-15)30(26,27)22-16-6-5-7-18(14-16)31(28,29)23-20-9-4-3-8-19(20)21(24)25/h3-14,22-23H,2H2,1H3,(H,24,25)