O5-ethyl O1-methyl 2-[2,2-dimethyl-3-oxidanylidene-3-[(4-sulfamoylphenyl)amino]propyl]-2,4-dimethyl-pentanedioate

Systemtic Name: O5-ethyl O1-methyl 2-[2,2-dimethyl-3-oxidanylidene-3-[(4-sulfamoylphenyl)amino]propyl]-2,4-dimethyl-pentanedioate Openeye Name: O5-ethyl O1-methyl 2-[2,2-dimethyl-3-oxo-3-(4-sulfamoylanilino)propyl]-2,4-dimethyl-pentanedioate CAS Name: 2-[2,2-dimethyl-3-oxo-3-(4-sulfamoylanilino)propyl]-2,4-dimethylpentanedioic acid O5-ethyl ester O1-methyl ester IUPAC Name: 5-O-ethyl 1-O-methyl 2-[2,2-dimethyl-3-oxo-3-(4-sulfamoylanilino)propyl]-2,4-dimethylpentanedioate Traditional Name: 2-[3-keto-2,2-dimethyl-3-(4-sulfamoylanilino)propyl]-2,4-dimethyl-glutaric acid O5-ethyl ester O1-methyl ester Formula: C21H32N2O7S MolecularWeight: 456.55298

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)CC(C)(CC(C)(C)C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)C(=O)OC

Isomeric SMILES

CCOC(=O)C(C)CC(C)(CC(C)(C)C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)C(=O)OC

InChI

InChI=1S/C21H32N2O7S/c1-7-30-17(24)14(2)12-21(5,19(26)29-6)13-20(3,4)18(25)23-15-8-10-16(11-9-15)31(22,27)28/h8-11,14H,7,12-13H2,1-6H3,(H,23,25)(H2,22,27,28)