methyl 4-[[3-(phenylsulfonylmethyl)furan-2-yl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[3-(phenylsulfonylmethyl)furan-2-yl]carbonylamino]butanoate Openeye Name: methyl 4-[[3-(benzenesulfonylmethyl)furan-2-carbonyl]amino]butanoate CAS Name: 4-[[[3-(benzenesulfonylmethyl)-2-furanyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[3-(benzenesulfonylmethyl)furan-2-carbonyl]amino]butanoate Traditional Name: 4-[[3-(besylmethyl)-2-furoyl]amino]butyric acid methyl ester Formula: C17H19NO6S MolecularWeight: 365.40086

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)C1=C(C=CO1)CS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CCCNC(=O)C1=C(C=CO1)CS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H19NO6S/c1-23-15(19)8-5-10-18-17(20)16-13(9-11-24-16)12-25(21,22)14-6-3-2-4-7-14/h2-4,6-7,9,11H,5,8,10,12H2,1H3,(H,18,20)