4-[3-(3-chloranyl-2,4,6-trimethoxy-phenyl)-5-ethyl-1,2-oxazol-4-yl]benzenesulfonamide

Systemtic Name: 4-[3-(3-chloranyl-2,4,6-trimethoxy-phenyl)-5-ethyl-1,2-oxazol-4-yl]benzenesulfonamide Openeye Name: 4-[3-(3-chloro-2,4,6-trimethoxy-phenyl)-5-ethyl-isoxazol-4-yl]benzenesulfonamide CAS Name: 4-[3-(3-chloro-2,4,6-trimethoxyphenyl)-5-ethyl-4-isoxazolyl]benzenesulfonamide IUPAC Name: 4-[3-(3-chloro-2,4,6-trimethoxyphenyl)-5-ethyl-1,2-oxazol-4-yl]benzenesulfonamide Traditional Name: 4-[3-(3-chloro-2,4,6-trimethoxy-phenyl)-5-ethyl-isoxazol-4-yl]benzenesulfonamide Formula: C20H21ClN2O6S MolecularWeight: 452.90854

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NO1)C2=C(C(=C(C=C2OC)OC)Cl)OC)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CCC1=C(C(=NO1)C2=C(C(=C(C=C2OC)OC)Cl)OC)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C20H21ClN2O6S/c1-5-13-16(11-6-8-12(9-7-11)30(22,24)25)19(23-29-13)17-14(26-2)10-15(27-3)18(21)20(17)28-4/h6-10H,5H2,1-4H3,(H2,22,24,25)