[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 3-[(phenylmethyl)sulfamoyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 3-[(phenylmethyl)sulfamoyl]benzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 3-(benzylsulfamoyl)benzoate CAS Name: 3-[(phenylmethyl)sulfamoyl]benzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 3-(benzylsulfamoyl)benzoate Traditional Name: 3-(benzylsulfamoyl)benzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)NCC2=CC=CC=C2

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O5S/c1-3-18(4-2)23-20(24)15-28-21(25)17-11-8-12-19(13-17)29(26,27)22-14-16-9-6-5-7-10-16/h5-13,18,22H,3-4,14-15H2,1-2H3,(H,23,24)