4-[4-[[1-methoxy-3-(methylamino)-1-oxidanylidene-propan-2-yl]sulfamoyl]-3,5-dimethyl-phenoxy]butanoic acid

Systemtic Name: 4-[4-[[1-methoxy-3-(methylamino)-1-oxidanylidene-propan-2-yl]sulfamoyl]-3,5-dimethyl-phenoxy]butanoic acid Openeye Name: 4-[4-[[2-methoxy-1-(methylaminomethyl)-2-oxo-ethyl]sulfamoyl]-3,5-dimethyl-phenoxy]butanoic acid CAS Name: 4-[4-[[1-methoxy-3-(methylamino)-1-oxopropan-2-yl]sulfamoyl]-3,5-dimethylphenoxy]butanoic acid IUPAC Name: 4-[4-[[1-methoxy-3-(methylamino)-1-oxopropan-2-yl]sulfamoyl]-3,5-dimethylphenoxy]butanoic acid Traditional Name: 4-[4-[[2-keto-2-methoxy-1-(methylaminomethyl)ethyl]sulfamoyl]-3,5-dimethyl-phenoxy]butyric acid Formula: C17H26N2O7S MolecularWeight: 402.46254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)NC(CNC)C(=O)OC)C)OCCCC(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)NC(CNC)C(=O)OC)C)OCCCC(=O)O

InChI

InChI=1S/C17H26N2O7S/c1-11-8-13(26-7-5-6-15(20)21)9-12(2)16(11)27(23,24)19-14(10-18-3)17(22)25-4/h8-9,14,18-19H,5-7,10H2,1-4H3,(H,20,21)