(2-cyanophenyl)methyl 2-bromanyl-5-sulfamoyl-benzoate

Systemtic Name: (2-cyanophenyl)methyl 2-bromanyl-5-sulfamoyl-benzoate Openeye Name: (2-cyanophenyl)methyl 2-bromo-5-sulfamoyl-benzoate CAS Name: 2-bromo-5-sulfamoylbenzoic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 2-bromo-5-sulfamoylbenzoate Traditional Name: 2-bromo-5-sulfamoyl-benzoic acid (2-cyanobenzyl) ester Formula: C15H11BrN2O4S MolecularWeight: 395.22784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11BrN2O4S/c16-14-6-5-12(23(18,20)21)7-13(14)15(19)22-9-11-4-2-1-3-10(11)8-17/h1-7H,9H2,(H2,18,20,21)