[2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl] 4-[(4-fluorophenyl)sulfonylamino]butanoate

Systemtic Name: [2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl] 4-[(4-fluorophenyl)sulfonylamino]butanoate Openeye Name: [2-(2,5-dimethylphenyl)-2-oxo-ethyl] 4-[(4-fluorophenyl)sulfonylamino]butanoate CAS Name: 4-[(4-fluorophenyl)sulfonylamino]butanoic acid [2-(2,5-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethylphenyl)-2-oxoethyl] 4-[(4-fluorophenyl)sulfonylamino]butanoate Traditional Name: 4-[(4-fluorophenyl)sulfonylamino]butyric acid [2-(2,5-dimethylphenyl)-2-keto-ethyl] ester Formula: C20H22FNO5S MolecularWeight: 407.455783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)COC(=O)CCCNS(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)COC(=O)CCCNS(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C20H22FNO5S/c1-14-5-6-15(2)18(12-14)19(23)13-27-20(24)4-3-11-22-28(25,26)17-9-7-16(21)8-10-17/h5-10,12,22H,3-4,11,13H2,1-2H3