methyl 4-bromanyl-2-propyl-5-sulfamoyl-benzoate

Systemtic Name: methyl 4-bromanyl-2-propyl-5-sulfamoyl-benzoate Openeye Name: methyl 4-bromo-2-propyl-5-sulfamoyl-benzoate CAS Name: 4-bromo-2-propyl-5-sulfamoylbenzoic acid methyl ester IUPAC Name: methyl 4-bromo-2-propyl-5-sulfamoylbenzoate Traditional Name: 4-bromo-2-propyl-5-sulfamoyl-benzoic acid methyl ester Formula: C11H14BrNO4S MolecularWeight: 336.20216

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)N)Br

Isomeric SMILES

CCCC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)N)Br

InChI

InChI=1S/C11H14BrNO4S/c1-3-4-7-5-9(12)10(18(13,15)16)6-8(7)11(14)17-2/h5-6H,3-4H2,1-2H3,(H2,13,15,16)