3-ethanoyl-2-sulfamoyloxy-4-[2,4,6-tri(propan-2-yl)phenyl]benzoic acid

Systemtic Name: 3-ethanoyl-2-sulfamoyloxy-4-[2,4,6-tri(propan-2-yl)phenyl]benzoic acid Openeye Name: 3-acetyl-2-sulfamoyloxy-4-(2,4,6-triisopropylphenyl)benzoic acid CAS Name: 3-acetyl-2-sulfamoyloxy-4-[2,4,6-tri(propan-2-yl)phenyl]benzoic acid IUPAC Name: 3-acetyl-2-sulfamoyloxy-4-[2,4,6-tri(propan-2-yl)phenyl]benzoic acid Traditional Name: 3-acetyl-2-sulfamoyloxy-4-(2,4,6-triisopropylphenyl)benzoic acid Formula: C24H31NO6S MolecularWeight: 461.57104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)C(C)C)C2=C(C(=C(C=C2)C(=O)O)OS(=O)(=O)N)C(=O)C)C(C)C

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)C(C)C)C2=C(C(=C(C=C2)C(=O)O)OS(=O)(=O)N)C(=O)C)C(C)C

InChI

InChI=1S/C24H31NO6S/c1-12(2)16-10-19(13(3)4)22(20(11-16)14(5)6)17-8-9-18(24(27)28)23(21(17)15(7)26)31-32(25,29)30/h8-14H,1-7H3,(H,27,28)(H2,25,29,30)