2-bromanyl-5-[(4-pentylphenyl)sulfamoyl]benzoate

Systemtic Name: 2-bromanyl-5-[(4-pentylphenyl)sulfamoyl]benzoate Openeye Name: 2-bromo-5-[(4-pentylphenyl)sulfamoyl]benzoate CAS Name: 2-bromo-5-[(4-pentylphenyl)sulfamoyl]benzoate IUPAC Name: 2-bromo-5-[(4-pentylphenyl)sulfamoyl]benzoate Traditional Name: 5-[(4-amylphenyl)sulfamoyl]-2-bromo-benzoate Formula: C18H19BrNO4S- MolecularWeight: 425.31676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)[O-]

Isomeric SMILES

CCCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)[O-]

InChI

InChI=1S/C18H20BrNO4S/c1-2-3-4-5-13-6-8-14(9-7-13)20-25(23,24)15-10-11-17(19)16(12-15)18(21)22/h6-12,20H,2-5H2,1H3,(H,21,22)/p-1