methyl 4-[3-(methylsulfonyloxymethyl)-2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]butanoate

Systemtic Name: methyl 4-[3-(methylsulfonyloxymethyl)-2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]butanoate Openeye Name: methyl 4-[3-(methylsulfonyloxymethyl)-2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]butanoate CAS Name: 4-[3-(methylsulfonyloxymethyl)-2-oxo-1-(3-phenylpropyl)-3-pyrrolidinyl]butanoic acid methyl ester IUPAC Name: methyl 4-[3-(methylsulfonyloxymethyl)-2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]butanoate Traditional Name: 4-[2-keto-3-(methylsulfonyloxymethyl)-1-(3-phenylpropyl)pyrrolidin-3-yl]butyric acid methyl ester Formula: C20H29NO6S MolecularWeight: 411.51236

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1(CCN(C1=O)CCCC2=CC=CC=C2)COS(=O)(=O)C

Isomeric SMILES

COC(=O)CCCC1(CCN(C1=O)CCCC2=CC=CC=C2)COS(=O)(=O)C

InChI

InChI=1S/C20H29NO6S/c1-26-18(22)11-6-12-20(16-27-28(2,24)25)13-15-21(19(20)23)14-7-10-17-8-4-3-5-9-17/h3-5,8-9H,6-7,10-16H2,1-2H3