[2-(butylamino)-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)sulfonylpropanoate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)sulfonylpropanoate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 3-(4-fluorophenyl)sulfonylpropanoate CAS Name: 3-(4-fluorophenyl)sulfonylpropanoic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 3-(4-fluorophenyl)sulfonylpropanoate Traditional Name: 3-(4-fluorophenyl)sulfonylpropionic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C15H20FNO5S MolecularWeight: 345.386403

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)CCS(=O)(=O)C1=CC=C(C=C1)F

Isomeric SMILES

CCCCNC(=O)COC(=O)CCS(=O)(=O)C1=CC=C(C=C1)F

InChI

InChI=1S/C15H20FNO5S/c1-2-3-9-17-14(18)11-22-15(19)8-10-23(20,21)13-6-4-12(16)5-7-13/h4-7H,2-3,8-11H2,1H3,(H,17,18)