3-[(3-tert-butyl-4-ethoxy-phenyl)sulfonylamino]benzoic acid

Systemtic Name: 3-[(3-tert-butyl-4-ethoxy-phenyl)sulfonylamino]benzoic acid Openeye Name: 3-[(3-tert-butyl-4-ethoxy-phenyl)sulfonylamino]benzoic acid CAS Name: 3-[(3-tert-butyl-4-ethoxyphenyl)sulfonylamino]benzoic acid IUPAC Name: 3-[(3-tert-butyl-4-ethoxyphenyl)sulfonylamino]benzoic acid Traditional Name: 3-[(3-tert-butyl-4-ethoxy-phenyl)sulfonylamino]benzoic acid Formula: C19H23NO5S MolecularWeight: 377.45462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)O)C(C)(C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)O)C(C)(C)C

InChI

InChI=1S/C19H23NO5S/c1-5-25-17-10-9-15(12-16(17)19(2,3)4)26(23,24)20-14-8-6-7-13(11-14)18(21)22/h6-12,20H,5H2,1-4H3,(H,21,22)