(3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-chloranyl-3-[(phenylmethyl)sulfamoyl]benzoate

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-chloranyl-3-[(phenylmethyl)sulfamoyl]benzoate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl 3-(benzylsulfamoyl)-4-chloro-benzoate CAS Name: 4-chloro-3-[(phenylmethyl)sulfamoyl]benzoic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 3-(benzylsulfamoyl)-4-chlorobenzoate Traditional Name: 3-(benzylsulfamoyl)-4-chloro-benzoic acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C20H19ClN2O5S MolecularWeight: 434.89326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NO1)C)COC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C20H19ClN2O5S/c1-13-17(14(2)28-23-13)12-27-20(24)16-8-9-18(21)19(10-16)29(25,26)22-11-15-6-4-3-5-7-15/h3-10,22H,11-12H2,1-2H3