3-chloranyl-2-oxidanyl-5-[[2,4,6-tri(propan-2-yl)phenyl]sulfonylamino]benzoic acid

Systemtic Name: 3-chloranyl-2-oxidanyl-5-[[2,4,6-tri(propan-2-yl)phenyl]sulfonylamino]benzoic acid Openeye Name: 3-chloro-2-hydroxy-5-[(2,4,6-triisopropylphenyl)sulfonylamino]benzoic acid CAS Name: 3-chloro-2-hydroxy-5-[[2,4,6-tri(propan-2-yl)phenyl]sulfonylamino]benzoic acid IUPAC Name: 3-chloro-2-hydroxy-5-[[2,4,6-tri(propan-2-yl)phenyl]sulfonylamino]benzoic acid Traditional Name: 3-chloro-2-hydroxy-5-[(2,4,6-triisopropylphenyl)sulfonylamino]benzoic acid Formula: C22H28ClNO5S MolecularWeight: 453.97942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28ClNO5S/c1-11(2)14-7-16(12(3)4)21(17(8-14)13(5)6)30(28,29)24-15-9-18(22(26)27)20(25)19(23)10-15/h7-13,24-25H,1-6H3,(H,26,27)