[2-(3-fluorophenyl)-2-oxidanylidene-ethyl] 4-[(3,4-dimethylphenyl)sulfonylamino]butanoate

Systemtic Name: [2-(3-fluorophenyl)-2-oxidanylidene-ethyl] 4-[(3,4-dimethylphenyl)sulfonylamino]butanoate Openeye Name: [2-(3-fluorophenyl)-2-oxo-ethyl] 4-[(3,4-dimethylphenyl)sulfonylamino]butanoate CAS Name: 4-[(3,4-dimethylphenyl)sulfonylamino]butanoic acid [2-(3-fluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-fluorophenyl)-2-oxoethyl] 4-[(3,4-dimethylphenyl)sulfonylamino]butanoate Traditional Name: 4-[(3,4-dimethylphenyl)sulfonylamino]butyric acid [2-(3-fluorophenyl)-2-keto-ethyl] ester Formula: C20H22FNO5S MolecularWeight: 407.455783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCCC(=O)OCC(=O)C2=CC(=CC=C2)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCCC(=O)OCC(=O)C2=CC(=CC=C2)F)C

InChI

InChI=1S/C20H22FNO5S/c1-14-8-9-18(11-15(14)2)28(25,26)22-10-4-7-20(24)27-13-19(23)16-5-3-6-17(21)12-16/h3,5-6,8-9,11-12,22H,4,7,10,13H2,1-2H3