5-morpholin-4-ylsulfonyl-2-[1-oxidanylidene-1-[(2-propan-2-ylphenyl)amino]propan-2-yl]oxy-benzoic acid

Systemtic Name: 5-morpholin-4-ylsulfonyl-2-[1-oxidanylidene-1-[(2-propan-2-ylphenyl)amino]propan-2-yl]oxy-benzoic acid Openeye Name: 2-[2-(2-isopropylanilino)-1-methyl-2-oxo-ethoxy]-5-morpholinosulfonyl-benzoic acid CAS Name: 5-(4-morpholinylsulfonyl)-2-[1-oxo-1-(2-propan-2-ylanilino)propan-2-yl]oxybenzoic acid IUPAC Name: 5-morpholin-4-ylsulfonyl-2-[1-oxo-1-(2-propan-2-ylanilino)propan-2-yl]oxybenzoic acid Traditional Name: 2-[2-(2-isopropylanilino)-2-keto-1-methyl-ethoxy]-5-morpholinosulfonyl-benzoic acid Formula: C23H28N2O7S MolecularWeight: 476.54262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)C(C)OC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)O

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)C(C)OC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=O)O

InChI

InChI=1S/C23H28N2O7S/c1-15(2)18-6-4-5-7-20(18)24-22(26)16(3)32-21-9-8-17(14-19(21)23(27)28)33(29,30)25-10-12-31-13-11-25/h4-9,14-16H,10-13H2,1-3H3,(H,24,26)(H,27,28)