[2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl] 4-butoxy-3-ethoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-[(3-sulfamoylphenyl)amino]ethyl] 4-butoxy-3-ethoxy-benzoate Openeye Name: [2-oxo-2-(3-sulfamoylanilino)ethyl] 4-butoxy-3-ethoxy-benzoate CAS Name: 4-butoxy-3-ethoxybenzoic acid [2-oxo-2-(3-sulfamoylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(3-sulfamoylanilino)ethyl] 4-butoxy-3-ethoxybenzoate Traditional Name: 4-butoxy-3-ethoxy-benzoic acid [2-keto-2-(3-sulfamoylanilino)ethyl] ester Formula: C21H26N2O7S MolecularWeight: 450.50534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N)OCC

InChI

InChI=1S/C21H26N2O7S/c1-3-5-11-29-18-10-9-15(12-19(18)28-4-2)21(25)30-14-20(24)23-16-7-6-8-17(13-16)31(22,26)27/h6-10,12-13H,3-5,11,14H2,1-2H3,(H,23,24)(H2,22,26,27)