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

Systemtic Name: [2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl] 4-[(3,4-dimethylphenyl)sulfonylamino]benzoate Openeye Name: [2-(2,5-dimethylphenyl)-2-oxo-ethyl] 4-[(3,4-dimethylphenyl)sulfonylamino]benzoate CAS Name: 4-[(3,4-dimethylphenyl)sulfonylamino]benzoic acid [2-(2,5-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethylphenyl)-2-oxoethyl] 4-[(3,4-dimethylphenyl)sulfonylamino]benzoate Traditional Name: 4-[(3,4-dimethylphenyl)sulfonylamino]benzoic acid [2-(2,5-dimethylphenyl)-2-keto-ethyl] ester Formula: C25H25NO5S MolecularWeight: 451.5347

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)COC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)COC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C25H25NO5S/c1-16-5-6-18(3)23(13-16)24(27)15-31-25(28)20-8-10-21(11-9-20)26-32(29,30)22-12-7-17(2)19(4)14-22/h5-14,26H,15H2,1-4H3