(2-oxidanylideneazepan-3-yl) 3-[(4-butylphenyl)sulfamoyl]benzoate

Systemtic Name: (2-oxidanylideneazepan-3-yl) 3-[(4-butylphenyl)sulfamoyl]benzoate Openeye Name: (2-oxoazepan-3-yl) 3-[(4-butylphenyl)sulfamoyl]benzoate CAS Name: 3-[(4-butylphenyl)sulfamoyl]benzoic acid (2-oxo-3-azepanyl) ester IUPAC Name: (2-oxoazepan-3-yl) 3-[(4-butylphenyl)sulfamoyl]benzoate Traditional Name: 3-[(4-butylphenyl)sulfamoyl]benzoic acid (2-ketoazepan-3-yl) ester Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OC3CCCCNC3=O

Isomeric SMILES

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OC3CCCCNC3=O

InChI

InChI=1S/C23H28N2O5S/c1-2-3-7-17-11-13-19(14-12-17)25-31(28,29)20-9-6-8-18(16-20)23(27)30-21-10-4-5-15-24-22(21)26/h6,8-9,11-14,16,21,25H,2-5,7,10,15H2,1H3,(H,24,26)