2,2-dimethylpropanoyloxymethyl 3-(butylamino)-4-phenoxy-5-sulfamoyl-benzoate

Systemtic Name: 2,2-dimethylpropanoyloxymethyl 3-(butylamino)-4-phenoxy-5-sulfamoyl-benzoate Openeye Name: 2,2-dimethylpropanoyloxymethyl 3-(butylamino)-4-phenoxy-5-sulfamoyl-benzoate CAS Name: 3-(butylamino)-4-phenoxy-5-sulfamoylbenzoic acid (2,2-dimethyl-1-oxopropoxy)methyl ester IUPAC Name: 2,2-dimethylpropanoyloxymethyl 3-(butylamino)-4-phenoxy-5-sulfamoylbenzoate Traditional Name: 3-(butylamino)-4-phenoxy-5-sulfamoyl-benzoic acid pivaloyloxymethyl ester Formula: C23H30N2O7S MolecularWeight: 478.5585

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=CC(=C1)C(=O)OCOC(=O)C(C)(C)C)S(=O)(=O)N)OC2=CC=CC=C2

Isomeric SMILES

CCCCNC1=C(C(=CC(=C1)C(=O)OCOC(=O)C(C)(C)C)S(=O)(=O)N)OC2=CC=CC=C2

InChI

InChI=1S/C23H30N2O7S/c1-5-6-12-25-18-13-16(21(26)30-15-31-22(27)23(2,3)4)14-19(33(24,28)29)20(18)32-17-10-8-7-9-11-17/h7-11,13-14,25H,5-6,12,15H2,1-4H3,(H2,24,28,29)