ethyl 2-[6-nitro-2-[2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfonylethanoylimino]-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[6-nitro-2-[2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfonylethanoylimino]-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[6-nitro-2-[2-[2-oxo-2-(1-piperidyl)ethyl]sulfonylacetyl]imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-nitro-2-[1-oxo-2-[2-oxo-2-(1-piperidinyl)ethyl]sulfonylethyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-nitro-2-[2-(2-oxo-2-piperidin-1-ylethyl)sulfonylacetyl]imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[2-(2-keto-2-piperidino-ethyl)sulfonylacetyl]imino-6-nitro-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C20H24N4O8S2 MolecularWeight: 512.55656

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)CS(=O)(=O)CC(=O)N3CCCCC3

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)CS(=O)(=O)CC(=O)N3CCCCC3

InChI

InChI=1S/C20H24N4O8S2/c1-2-32-19(27)11-23-15-7-6-14(24(28)29)10-16(15)33-20(23)21-17(25)12-34(30,31)13-18(26)22-8-4-3-5-9-22/h6-7,10H,2-5,8-9,11-13H2,1H3