5-bromanyl-N-(4-butanoylphenyl)-2-methoxy-benzenesulfonamide

Systemtic Name: 5-bromanyl-N-(4-butanoylphenyl)-2-methoxy-benzenesulfonamide Openeye Name: 5-bromo-N-(4-butanoylphenyl)-2-methoxy-benzenesulfonamide CAS Name: 5-bromo-2-methoxy-N-[4-(1-oxobutyl)phenyl]benzenesulfonamide IUPAC Name: 5-bromo-N-(4-butanoylphenyl)-2-methoxybenzenesulfonamide Traditional Name: 5-bromo-N-(4-butyrylphenyl)-2-methoxy-benzenesulfonamide Formula: C17H18BrNO4S MolecularWeight: 412.29812

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CCCC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C17H18BrNO4S/c1-3-4-15(20)12-5-8-14(9-6-12)19-24(21,22)17-11-13(18)7-10-16(17)23-2/h5-11,19H,3-4H2,1-2H3