ethyl 5-[3-(1,3-benzodioxol-5-ylmethylsulfamoyl)-4-methoxy-phenyl]-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl 5-[3-(1,3-benzodioxol-5-ylmethylsulfamoyl)-4-methoxy-phenyl]-1,2-oxazole-3-carboxylate Openeye Name: ethyl 5-[3-(1,3-benzodioxol-5-ylmethylsulfamoyl)-4-methoxy-phenyl]isoxazole-3-carboxylate CAS Name: 5-[3-(1,3-benzodioxol-5-ylmethylsulfamoyl)-4-methoxyphenyl]-3-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-(1,3-benzodioxol-5-ylmethylsulfamoyl)-4-methoxyphenyl]-1,2-oxazole-3-carboxylate Traditional Name: 5-[4-methoxy-3-(piperonylsulfamoyl)phenyl]isoxazole-3-carboxylic acid ethyl ester Formula: C21H20N2O8S MolecularWeight: 460.4571

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC(=C1)C2=CC(=C(C=C2)OC)S(=O)(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)C1=NOC(=C1)C2=CC(=C(C=C2)OC)S(=O)(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H20N2O8S/c1-3-28-21(24)15-10-18(31-23-15)14-5-7-17(27-2)20(9-14)32(25,26)22-11-13-4-6-16-19(8-13)30-12-29-16/h4-10,22H,3,11-12H2,1-2H3