[2-oxidanylidene-2-(phenethylamino)ethyl] 3-[(4-butylphenyl)sulfamoyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(phenethylamino)ethyl] 3-[(4-butylphenyl)sulfamoyl]benzoate Openeye Name: [2-oxo-2-(phenethylamino)ethyl] 3-[(4-butylphenyl)sulfamoyl]benzoate CAS Name: 3-[(4-butylphenyl)sulfamoyl]benzoic acid [2-oxo-2-(phenethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(phenethylamino)ethyl] 3-[(4-butylphenyl)sulfamoyl]benzoate Traditional Name: 3-[(4-butylphenyl)sulfamoyl]benzoic acid [2-keto-2-(phenethylamino)ethyl] ester Formula: C27H30N2O5S MolecularWeight: 494.6025

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C27H30N2O5S/c1-2-3-8-22-13-15-24(16-14-22)29-35(32,33)25-12-7-11-23(19-25)27(31)34-20-26(30)28-18-17-21-9-5-4-6-10-21/h4-7,9-16,19,29H,2-3,8,17-18,20H2,1H3,(H,28,30)