4-oxidanylidene-3-[[2-(4-propan-2-ylphenoxy)phenyl]sulfonylamino]butanoic acid

Systemtic Name: 4-oxidanylidene-3-[[2-(4-propan-2-ylphenoxy)phenyl]sulfonylamino]butanoic acid Openeye Name: 3-[[2-(4-isopropylphenoxy)phenyl]sulfonylamino]-4-oxo-butanoic acid CAS Name: 4-oxo-3-[[2-(4-propan-2-ylphenoxy)phenyl]sulfonylamino]butanoic acid IUPAC Name: 4-oxo-3-[[2-(4-propan-2-ylphenoxy)phenyl]sulfonylamino]butanoic acid Traditional Name: 3-[[2-(4-isopropylphenoxy)phenyl]sulfonylamino]-4-keto-butyric acid Formula: C19H21NO6S MolecularWeight: 391.43814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2=CC=CC=C2S(=O)(=O)NC(CC(=O)O)C=O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2=CC=CC=C2S(=O)(=O)NC(CC(=O)O)C=O

InChI

InChI=1S/C19H21NO6S/c1-13(2)14-7-9-16(10-8-14)26-17-5-3-4-6-18(17)27(24,25)20-15(12-21)11-19(22)23/h3-10,12-13,15,20H,11H2,1-2H3,(H,22,23)