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

Systemtic Name: [2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl] 3-(2-phenylethenylsulfonylamino)benzoate Openeye Name: [2-(2,5-dimethylphenyl)-2-oxo-ethyl] 3-(styrylsulfonylamino)benzoate CAS Name: 3-(2-phenylethenylsulfonylamino)benzoic acid [2-(2,5-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethylphenyl)-2-oxoethyl] 3-(2-phenylethenylsulfonylamino)benzoate Traditional Name: 3-(styrylsulfonylamino)benzoic acid [2-(2,5-dimethylphenyl)-2-keto-ethyl] ester Formula: C25H23NO5S MolecularWeight: 449.51882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)COC(=O)C2=CC(=CC=C2)NS(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)COC(=O)C2=CC(=CC=C2)NS(=O)(=O)C=CC3=CC=CC=C3

InChI

InChI=1S/C25H23NO5S/c1-18-11-12-19(2)23(15-18)24(27)17-31-25(28)21-9-6-10-22(16-21)26-32(29,30)14-13-20-7-4-3-5-8-20/h3-16,26H,17H2,1-2H3