4-[[4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)phenyl]sulfonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)phenyl]sulfonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[4-(5-methyl-3-phenyl-isoxazol-4-yl)phenyl]sulfonylamino]-4-oxo-butanoic acid CAS Name: 4-[[4-(5-methyl-3-phenyl-4-isoxazolyl)phenyl]sulfonylamino]-4-oxobutanoic acid IUPAC Name: 4-[[4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)phenyl]sulfonylamino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[[4-(5-methyl-3-phenyl-isoxazol-4-yl)phenyl]sulfonylamino]butyric acid Formula: C20H18N2O6S MolecularWeight: 414.43172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)NC(=O)CCC(=O)O

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)NC(=O)CCC(=O)O

InChI

InChI=1S/C20H18N2O6S/c1-13-19(20(21-28-13)15-5-3-2-4-6-15)14-7-9-16(10-8-14)29(26,27)22-17(23)11-12-18(24)25/h2-10H,11-12H2,1H3,(H,22,23)(H,24,25)