3-[(4-bromanyl-5-methyl-2-propan-2-yl-phenyl)sulfonylamino]benzoate

Systemtic Name: 3-[(4-bromanyl-5-methyl-2-propan-2-yl-phenyl)sulfonylamino]benzoate Openeye Name: 3-[(4-bromo-2-isopropyl-5-methyl-phenyl)sulfonylamino]benzoate CAS Name: 3-[(4-bromo-5-methyl-2-propan-2-ylphenyl)sulfonylamino]benzoate IUPAC Name: 3-[(4-bromo-5-methyl-2-propan-2-ylphenyl)sulfonylamino]benzoate Traditional Name: 3-[(4-bromo-2-isopropyl-5-methyl-phenyl)sulfonylamino]benzoate Formula: C17H17BrNO4S- MolecularWeight: 411.29018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C(C)C)S(=O)(=O)NC2=CC=CC(=C2)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1Br)C(C)C)S(=O)(=O)NC2=CC=CC(=C2)C(=O)[O-]

InChI

InChI=1S/C17H18BrNO4S/c1-10(2)14-9-15(18)11(3)7-16(14)24(22,23)19-13-6-4-5-12(8-13)17(20)21/h4-10,19H,1-3H3,(H,20,21)/p-1