4-oxidanylidene-3-[[2-(3,4,5-trimethylphenoxy)phenyl]sulfonylamino]butanoic acid

Systemtic Name: 4-oxidanylidene-3-[[2-(3,4,5-trimethylphenoxy)phenyl]sulfonylamino]butanoic acid Openeye Name: 4-oxo-3-[[2-(3,4,5-trimethylphenoxy)phenyl]sulfonylamino]butanoic acid CAS Name: 4-oxo-3-[[2-(3,4,5-trimethylphenoxy)phenyl]sulfonylamino]butanoic acid IUPAC Name: 4-oxo-3-[[2-(3,4,5-trimethylphenoxy)phenyl]sulfonylamino]butanoic acid Traditional Name: 4-keto-3-[[2-(3,4,5-trimethylphenoxy)phenyl]sulfonylamino]butyric acid Formula: C19H21NO6S MolecularWeight: 391.43814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)C)OC2=CC=CC=C2S(=O)(=O)NC(CC(=O)O)C=O

Isomeric SMILES

CC1=CC(=CC(=C1C)C)OC2=CC=CC=C2S(=O)(=O)NC(CC(=O)O)C=O

InChI

InChI=1S/C19H21NO6S/c1-12-8-16(9-13(2)14(12)3)26-17-6-4-5-7-18(17)27(24,25)20-15(11-21)10-19(22)23/h4-9,11,15,20H,10H2,1-3H3,(H,22,23)