methyl 5-bromanyl-2-[(4-propan-2-yloxycarbonylphenyl)sulfamoyl]benzoate

Systemtic Name: methyl 5-bromanyl-2-[(4-propan-2-yloxycarbonylphenyl)sulfamoyl]benzoate Openeye Name: methyl 5-bromo-2-[(4-isopropoxycarbonylphenyl)sulfamoyl]benzoate CAS Name: 5-bromo-2-[[4-[oxo(propan-2-yloxy)methyl]phenyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[(4-propan-2-yloxycarbonylphenyl)sulfamoyl]benzoate Traditional Name: 5-bromo-2-[(4-isopropoxycarbonylphenyl)sulfamoyl]benzoic acid methyl ester Formula: C18H18BrNO6S MolecularWeight: 456.30762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrNO6S/c1-11(2)26-17(21)12-4-7-14(8-5-12)20-27(23,24)16-9-6-13(19)10-15(16)18(22)25-3/h4-11,20H,1-3H3