[1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl] 4-pentoxybenzoate

Systemtic Name: [1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl] 4-pentoxybenzoate Openeye Name: [1-methyl-2-oxo-2-(4-sulfamoylanilino)ethyl] 4-pentoxybenzoate CAS Name: 4-pentoxybenzoic acid [1-oxo-1-(4-sulfamoylanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-sulfamoylanilino)propan-2-yl] 4-pentoxybenzoate Traditional Name: 4-amoxybenzoic acid [2-keto-1-methyl-2-(4-sulfamoylanilino)ethyl] ester Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)OC(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)OC(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C21H26N2O6S/c1-3-4-5-14-28-18-10-6-16(7-11-18)21(25)29-15(2)20(24)23-17-8-12-19(13-9-17)30(22,26)27/h6-13,15H,3-5,14H2,1-2H3,(H,23,24)(H2,22,26,27)