(4-propan-2-ylphenyl)methyl 2-bromanyl-5-sulfamoyl-benzoate

Systemtic Name: (4-propan-2-ylphenyl)methyl 2-bromanyl-5-sulfamoyl-benzoate Openeye Name: (4-isopropylphenyl)methyl 2-bromo-5-sulfamoyl-benzoate CAS Name: 2-bromo-5-sulfamoylbenzoic acid (4-propan-2-ylphenyl)methyl ester IUPAC Name: (4-propan-2-ylphenyl)methyl 2-bromo-5-sulfamoylbenzoate Traditional Name: 2-bromo-5-sulfamoyl-benzoic acid (4-isopropylbenzyl) ester Formula: C17H18BrNO4S MolecularWeight: 412.29812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)Br

Isomeric SMILES

CC(C)C1=CC=C(C=C1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)Br

InChI

InChI=1S/C17H18BrNO4S/c1-11(2)13-5-3-12(4-6-13)10-23-17(20)15-9-14(24(19,21)22)7-8-16(15)18/h3-9,11H,10H2,1-2H3,(H2,19,21,22)