methyl 4-[3-(phenylsulfonyl)propanoylamino]butanoate

Systemtic Name: methyl 4-[3-(phenylsulfonyl)propanoylamino]butanoate Openeye Name: methyl 4-[3-(benzenesulfonyl)propanoylamino]butanoate CAS Name: 4-[[3-(benzenesulfonyl)-1-oxopropyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[3-(benzenesulfonyl)propanoylamino]butanoate Traditional Name: 4-(3-besylpropanoylamino)butyric acid methyl ester Formula: C14H19NO5S MolecularWeight: 313.36936

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)CCS(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

COC(=O)CCCNC(=O)CCS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C14H19NO5S/c1-20-14(17)8-5-10-15-13(16)9-11-21(18,19)12-6-3-2-4-7-12/h2-4,6-7H,5,8-11H2,1H3,(H,15,16)