ethyl 4-[[3-(4-fluorophenyl)sulfonyloxyphenyl]methyl-(2-methoxyethyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[3-(4-fluorophenyl)sulfonyloxyphenyl]methyl-(2-methoxyethyl)amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[[3-(4-fluorophenyl)sulfonyloxyphenyl]methyl-(2-methoxyethyl)amino]-4-oxo-butanoate CAS Name: 4-[[3-(4-fluorophenyl)sulfonyloxyphenyl]methyl-(2-methoxyethyl)amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[[3-(4-fluorophenyl)sulfonyloxyphenyl]methyl-(2-methoxyethyl)amino]-4-oxobutanoate Traditional Name: 4-[[3-(4-fluorophenyl)sulfonyloxybenzyl]-(2-methoxyethyl)amino]-4-keto-butyric acid ethyl ester Formula: C22H26FNO7S MolecularWeight: 467.507743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N(CCOC)CC1=CC(=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)CCC(=O)N(CCOC)CC1=CC(=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C22H26FNO7S/c1-3-30-22(26)12-11-21(25)24(13-14-29-2)16-17-5-4-6-19(15-17)31-32(27,28)20-9-7-18(23)8-10-20/h4-10,15H,3,11-14,16H2,1-2H3