2-[3-(2-ethoxy-2-oxidanylidene-ethyl)-7-(methoxysulfonylamino)-1,1-bis(oxidanylidene)-1$l^{6},2,4-benzothiadiazin-2-yl]ethanesulfonate

Systemtic Name: 2-[3-(2-ethoxy-2-oxidanylidene-ethyl)-7-(methoxysulfonylamino)-1,1-bis(oxidanylidene)-1$l^{6},2,4-benzothiadiazin-2-yl]ethanesulfonate Openeye Name: 2-[3-(2-ethoxy-2-oxo-ethyl)-7-(methoxysulfonylamino)-1,1-dioxo-1$l^{6},2,4-benzothiadiazin-2-yl]ethanesulfonate CAS Name: 2-[3-(2-ethoxy-2-oxoethyl)-7-(methoxysulfonylamino)-1,1-dioxo-1$l^{6},2,4-benzothiadiazin-2-yl]ethanesulfonate IUPAC Name: 2-[3-(2-ethoxy-2-oxoethyl)-7-(methoxysulfonylamino)-1,1-dioxo-1$l^{6},2,4-benzothiadiazin-2-yl]ethanesulfonate Traditional Name: 2-[3-(2-ethoxy-2-keto-ethyl)-1,1-diketo-7-(methoxysulfonylamino)-1$l^{6},2,4-benzothiadiazin-2-yl]ethanesulfonate Formula: C14H18N3O10S3- MolecularWeight: 484.50182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NC2=C(C=C(C=C2)NS(=O)(=O)OC)S(=O)(=O)N1CCS(=O)(=O)[O-]

Isomeric SMILES

CCOC(=O)CC1=NC2=C(C=C(C=C2)NS(=O)(=O)OC)S(=O)(=O)N1CCS(=O)(=O)[O-]

InChI

InChI=1S/C14H19N3O10S3/c1-3-27-14(18)9-13-15-11-5-4-10(16-30(24,25)26-2)8-12(11)29(22,23)17(13)6-7-28(19,20)21/h4-5,8,16H,3,6-7,9H2,1-2H3,(H,19,20,21)/p-1