(2-methoxy-2-oxidanylidene-ethyl) 4-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]butanoate

Systemtic Name: (2-methoxy-2-oxidanylidene-ethyl) 4-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]butanoate Openeye Name: (2-methoxy-2-oxo-ethyl) 4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]butanoate CAS Name: 4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]butanoic acid (2-methoxy-2-oxoethyl) ester IUPAC Name: (2-methoxy-2-oxoethyl) 4-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]butanoate Traditional Name: 4-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]butyric acid (2-keto-2-methoxy-ethyl) ester Formula: C14H16N2O6S MolecularWeight: 340.35164

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC(=O)CCCNC1=NS(=O)(=O)C2=CC=CC=C21

Isomeric SMILES

COC(=O)COC(=O)CCCNC1=NS(=O)(=O)C2=CC=CC=C21

InChI

InChI=1S/C14H16N2O6S/c1-21-13(18)9-22-12(17)7-4-8-15-14-10-5-2-3-6-11(10)23(19,20)16-14/h2-3,5-6H,4,7-9H2,1H3,(H,15,16)