(3,3-dimethyl-2-oxidanylidene-butyl) 2-chloranyl-5-[(2-methoxyphenyl)-prop-2-enyl-sulfamoyl]benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-chloranyl-5-[(2-methoxyphenyl)-prop-2-enyl-sulfamoyl]benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 5-[allyl-(2-methoxyphenyl)sulfamoyl]-2-chloro-benzoate CAS Name: 2-chloro-5-[(2-methoxyphenyl)-prop-2-enylsulfamoyl]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-chloro-5-[(2-methoxyphenyl)-prop-2-enylsulfamoyl]benzoate Traditional Name: 5-[allyl-(2-methoxyphenyl)sulfamoyl]-2-chloro-benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C23H26ClNO6S MolecularWeight: 479.97364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(CC=C)C2=CC=CC=C2OC)Cl

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(CC=C)C2=CC=CC=C2OC)Cl

InChI

InChI=1S/C23H26ClNO6S/c1-6-13-25(19-9-7-8-10-20(19)30-5)32(28,29)16-11-12-18(24)17(14-16)22(27)31-15-21(26)23(2,3)4/h6-12,14H,1,13,15H2,2-5H3