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

Systemtic Name: O1-methyl O5-propyl 2-[2,2-dimethyl-3-oxidanylidene-3-[(4-sulfamoylphenyl)amino]propyl]-4-ethyl-2-methyl-pentanedioate Openeye Name: O1-methyl O5-propyl 2-[2,2-dimethyl-3-oxo-3-(4-sulfamoylanilino)propyl]-4-ethyl-2-methyl-pentanedioate CAS Name: 2-[2,2-dimethyl-3-oxo-3-(4-sulfamoylanilino)propyl]-4-ethyl-2-methylpentanedioic acid O1-methyl ester O5-propyl ester IUPAC Name: 1-O-methyl 5-O-propyl 2-[2,2-dimethyl-3-oxo-3-(4-sulfamoylanilino)propyl]-4-ethyl-2-methylpentanedioate Traditional Name: 4-ethyl-2-[3-keto-2,2-dimethyl-3-(4-sulfamoylanilino)propyl]-2-methyl-glutaric acid O1-methyl ester O5-propyl ester Formula: C23H36N2O7S MolecularWeight: 484.60614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H36N2O7S/c1-7-13-32-19(26)16(8-2)14-23(5,21(28)31-6)15-22(3,4)20(27)25-17-9-11-18(12-10-17)33(24,29)30/h9-12,16H,7-8,13-15H2,1-6H3,(H,25,27)(H2,24,29,30)