2-[(4-bromanyl-2,5-dimethyl-phenyl)sulfonylamino]benzoate

Systemtic Name: 2-[(4-bromanyl-2,5-dimethyl-phenyl)sulfonylamino]benzoate Openeye Name: 2-[(4-bromo-2,5-dimethyl-phenyl)sulfonylamino]benzoate CAS Name: 2-[(4-bromo-2,5-dimethylphenyl)sulfonylamino]benzoate IUPAC Name: 2-[(4-bromo-2,5-dimethylphenyl)sulfonylamino]benzoate Traditional Name: 2-[(4-bromo-2,5-dimethyl-phenyl)sulfonylamino]benzoate Formula: C15H13BrNO4S- MolecularWeight: 383.23702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)S(=O)(=O)NC2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)S(=O)(=O)NC2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C15H14BrNO4S/c1-9-8-14(10(2)7-12(9)16)22(20,21)17-13-6-4-3-5-11(13)15(18)19/h3-8,17H,1-2H3,(H,18,19)/p-1