[3-(2-methoxyphenyl)-1,2-oxazol-5-yl]methyl 4-(prop-2-ynylsulfamoyl)benzoate

Systemtic Name: [3-(2-methoxyphenyl)-1,2-oxazol-5-yl]methyl 4-(prop-2-ynylsulfamoyl)benzoate Openeye Name: [3-(2-methoxyphenyl)isoxazol-5-yl]methyl 4-(prop-2-ynylsulfamoyl)benzoate CAS Name: 4-(prop-2-ynylsulfamoyl)benzoic acid [3-(2-methoxyphenyl)-5-isoxazolyl]methyl ester IUPAC Name: [3-(2-methoxyphenyl)-1,2-oxazol-5-yl]methyl 4-(prop-2-ynylsulfamoyl)benzoate Traditional Name: 4-(propargylsulfamoyl)benzoic acid [3-(2-methoxyphenyl)isoxazol-5-yl]methyl ester Formula: C21H18N2O6S MolecularWeight: 426.44242

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NOC(=C2)COC(=O)C3=CC=C(C=C3)S(=O)(=O)NCC#C

Isomeric SMILES

COC1=CC=CC=C1C2=NOC(=C2)COC(=O)C3=CC=C(C=C3)S(=O)(=O)NCC#C

InChI

InChI=1S/C21H18N2O6S/c1-3-12-22-30(25,26)17-10-8-15(9-11-17)21(24)28-14-16-13-19(23-29-16)18-6-4-5-7-20(18)27-2/h1,4-11,13,22H,12,14H2,2H3