[1-oxidanylidene-1-[2-(4-sulfamoylphenyl)ethylamino]propan-2-yl] 4-butoxybenzoate

Systemtic Name: [1-oxidanylidene-1-[2-(4-sulfamoylphenyl)ethylamino]propan-2-yl] 4-butoxybenzoate Openeye Name: [1-methyl-2-oxo-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [1-oxo-1-[2-(4-sulfamoylphenyl)ethylamino]propan-2-yl] ester IUPAC Name: [1-oxo-1-[2-(4-sulfamoylphenyl)ethylamino]propan-2-yl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [2-keto-1-methyl-2-[2-(4-sulfamoylphenyl)ethylamino]ethyl] ester Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OC(C)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OC(C)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C22H28N2O6S/c1-3-4-15-29-19-9-7-18(8-10-19)22(26)30-16(2)21(25)24-14-13-17-5-11-20(12-6-17)31(23,27)28/h5-12,16H,3-4,13-15H2,1-2H3,(H,24,25)(H2,23,27,28)