methyl 5-bromanyl-2-[(3-ethynylphenyl)sulfamoyl]benzoate

Systemtic Name: methyl 5-bromanyl-2-[(3-ethynylphenyl)sulfamoyl]benzoate Openeye Name: methyl 5-bromo-2-[(3-ethynylphenyl)sulfamoyl]benzoate CAS Name: 5-bromo-2-[(3-ethynylphenyl)sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[(3-ethynylphenyl)sulfamoyl]benzoate Traditional Name: 5-bromo-2-[(3-ethynylphenyl)sulfamoyl]benzoic acid methyl ester Formula: C16H12BrNO4S MolecularWeight: 394.23978

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Br)S(=O)(=O)NC2=CC=CC(=C2)C#C

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Br)S(=O)(=O)NC2=CC=CC(=C2)C#C

InChI

InChI=1S/C16H12BrNO4S/c1-3-11-5-4-6-13(9-11)18-23(20,21)15-8-7-12(17)10-14(15)16(19)22-2/h1,4-10,18H,2H3