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

Systemtic Name: (5-methyl-1,2-oxazol-3-yl)methyl 4-chloranyl-3-[phenyl(prop-2-enyl)sulfamoyl]benzoate Openeye Name: (5-methylisoxazol-3-yl)methyl 3-[allyl(phenyl)sulfamoyl]-4-chloro-benzoate CAS Name: 4-chloro-3-[phenyl(prop-2-enyl)sulfamoyl]benzoic acid (5-methyl-3-isoxazolyl)methyl ester IUPAC Name: (5-methyl-1,2-oxazol-3-yl)methyl 4-chloro-3-[phenyl(prop-2-enyl)sulfamoyl]benzoate Traditional Name: 3-[allyl(phenyl)sulfamoyl]-4-chloro-benzoic acid (5-methylisoxazol-3-yl)methyl ester Formula: C21H19ClN2O5S MolecularWeight: 446.90396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19ClN2O5S/c1-3-11-24(18-7-5-4-6-8-18)30(26,27)20-13-16(9-10-19(20)22)21(25)28-14-17-12-15(2)29-23-17/h3-10,12-13H,1,11,14H2,2H3