2-(4-sulfamoylphenoxy)ethyl 4-(3,4-dimethylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: 2-(4-sulfamoylphenoxy)ethyl 4-(3,4-dimethylphenyl)-4-oxidanylidene-butanoate Openeye Name: 2-(4-sulfamoylphenoxy)ethyl 4-(3,4-dimethylphenyl)-4-oxo-butanoate CAS Name: 4-(3,4-dimethylphenyl)-4-oxobutanoic acid 2-(4-sulfamoylphenoxy)ethyl ester IUPAC Name: 2-(4-sulfamoylphenoxy)ethyl 4-(3,4-dimethylphenyl)-4-oxobutanoate Traditional Name: 4-(3,4-dimethylphenyl)-4-keto-butyric acid 2-(4-sulfamoylphenoxy)ethyl ester Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CCC(=O)OCCOC2=CC=C(C=C2)S(=O)(=O)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CCC(=O)OCCOC2=CC=C(C=C2)S(=O)(=O)N)C

InChI

InChI=1S/C20H23NO6S/c1-14-3-4-16(13-15(14)2)19(22)9-10-20(23)27-12-11-26-17-5-7-18(8-6-17)28(21,24)25/h3-8,13H,9-12H2,1-2H3,(H2,21,24,25)