[1-oxidanylidene-1-(propylamino)propan-2-yl] 3-[(4-methoxyphenyl)-methyl-sulfamoyl]benzoate

Systemtic Name: [1-oxidanylidene-1-(propylamino)propan-2-yl] 3-[(4-methoxyphenyl)-methyl-sulfamoyl]benzoate Openeye Name: [1-methyl-2-oxo-2-(propylamino)ethyl] 3-[(4-methoxyphenyl)-methyl-sulfamoyl]benzoate CAS Name: 3-[(4-methoxyphenyl)-methylsulfamoyl]benzoic acid [1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(propylamino)propan-2-yl] 3-[(4-methoxyphenyl)-methylsulfamoyl]benzoate Traditional Name: 3-[(4-methoxyphenyl)-methyl-sulfamoyl]benzoic acid [2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C1=CC(=CC=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCNC(=O)C(C)OC(=O)C1=CC(=CC=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OC

InChI

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