4-[3-[(4-chloranyl-3-methyl-1,2-oxazol-5-yl)sulfamoyl]thiophen-2-yl]-3-(6-methyl-1,3-benzodioxol-5-yl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[3-[(4-chloranyl-3-methyl-1,2-oxazol-5-yl)sulfamoyl]thiophen-2-yl]-3-(6-methyl-1,3-benzodioxol-5-yl)-4-oxidanylidene-butanoic acid Openeye Name: 4-[3-[(4-chloro-3-methyl-isoxazol-5-yl)sulfamoyl]-2-thienyl]-3-(6-methyl-1,3-benzodioxol-5-yl)-4-oxo-butanoic acid CAS Name: 4-[3-[(4-chloro-3-methyl-5-isoxazolyl)sulfamoyl]-2-thiophenyl]-3-(6-methyl-1,3-benzodioxol-5-yl)-4-oxobutanoic acid IUPAC Name: 4-[3-[(4-chloro-3-methyl-1,2-oxazol-5-yl)sulfamoyl]thiophen-2-yl]-3-(6-methyl-1,3-benzodioxol-5-yl)-4-oxobutanoic acid Traditional Name: 4-[3-[(4-chloro-3-methyl-isoxazol-5-yl)sulfamoyl]-2-thienyl]-4-keto-3-(6-methyl-1,3-benzodioxol-5-yl)butyric acid Formula: C20H17ClN2O8S2 MolecularWeight: 512.94058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C(CC(=O)O)C(=O)C3=C(C=CS3)S(=O)(=O)NC4=C(C(=NO4)C)Cl)OCO2

Isomeric SMILES

CC1=CC2=C(C=C1C(CC(=O)O)C(=O)C3=C(C=CS3)S(=O)(=O)NC4=C(C(=NO4)C)Cl)OCO2

InChI

InChI=1S/C20H17ClN2O8S2/c1-9-5-13-14(30-8-29-13)6-11(9)12(7-16(24)25)18(26)19-15(3-4-32-19)33(27,28)23-20-17(21)10(2)22-31-20/h3-6,12,23H,7-8H2,1-2H3,(H,24,25)