(2-butoxy-2-oxidanylidene-ethyl) 6-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]hexanoate

Systemtic Name: (2-butoxy-2-oxidanylidene-ethyl) 6-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]hexanoate Openeye Name: (2-butoxy-2-oxo-ethyl) 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanoate CAS Name: 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanoic acid (2-butoxy-2-oxoethyl) ester IUPAC Name: (2-butoxy-2-oxoethyl) 6-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanoate Traditional Name: 6-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]hexanoic acid (2-butoxy-2-keto-ethyl) ester Formula: C19H26N2O6S MolecularWeight: 410.48454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)COC(=O)CCCCCNC1=NS(=O)(=O)C2=CC=CC=C21

Isomeric SMILES

CCCCOC(=O)COC(=O)CCCCCNC1=NS(=O)(=O)C2=CC=CC=C21

InChI

InChI=1S/C19H26N2O6S/c1-2-3-13-26-18(23)14-27-17(22)11-5-4-8-12-20-19-15-9-6-7-10-16(15)28(24,25)21-19/h6-7,9-10H,2-5,8,11-14H2,1H3,(H,20,21)