(3-methyl-1,2-oxazol-5-yl)methyl 4-chloranyl-3-[(4-fluorophenyl)-prop-2-enyl-sulfamoyl]benzoate

Systemtic Name: (3-methyl-1,2-oxazol-5-yl)methyl 4-chloranyl-3-[(4-fluorophenyl)-prop-2-enyl-sulfamoyl]benzoate Openeye Name: (3-methylisoxazol-5-yl)methyl 3-[allyl-(4-fluorophenyl)sulfamoyl]-4-chloro-benzoate CAS Name: 4-chloro-3-[(4-fluorophenyl)-prop-2-enylsulfamoyl]benzoic acid (3-methyl-5-isoxazolyl)methyl ester IUPAC Name: (3-methyl-1,2-oxazol-5-yl)methyl 4-chloro-3-[(4-fluorophenyl)-prop-2-enylsulfamoyl]benzoate Traditional Name: 3-[allyl-(4-fluorophenyl)sulfamoyl]-4-chloro-benzoic acid (3-methylisoxazol-5-yl)methyl ester Formula: C21H18ClFN2O5S MolecularWeight: 464.894423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)COC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N(CC=C)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NOC(=C1)COC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N(CC=C)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H18ClFN2O5S/c1-3-10-25(17-7-5-16(23)6-8-17)31(27,28)20-12-15(4-9-19(20)22)21(26)29-13-18-11-14(2)24-30-18/h3-9,11-12H,1,10,13H2,2H3