[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]benzoate

Systemtic Name: [2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 4-[(5-bromanyl-2-ethoxy-phenyl)sulfonylamino]benzoate Openeye Name: [2-(3,4-dimethylphenyl)-2-oxo-ethyl] 4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]benzoate CAS Name: 4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]benzoic acid [2-(3,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylphenyl)-2-oxoethyl] 4-[(5-bromo-2-ethoxyphenyl)sulfonylamino]benzoate Traditional Name: 4-[(5-bromo-2-ethoxy-phenyl)sulfonylamino]benzoic acid [2-(3,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C25H24BrNO6S MolecularWeight: 546.43016

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C25H24BrNO6S/c1-4-32-23-12-9-20(26)14-24(23)34(30,31)27-21-10-7-18(8-11-21)25(29)33-15-22(28)19-6-5-16(2)17(3)13-19/h5-14,27H,4,15H2,1-3H3