ethyl 2-[2-[2-(4-methoxyphenyl)sulfonylethanoylimino]-5-nitro-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(4-methoxyphenyl)sulfonylethanoylimino]-5-nitro-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-[2-(4-methoxyphenyl)sulfonylacetyl]imino-5-nitro-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[2-(4-methoxyphenyl)sulfonyl-1-oxoethyl]imino-5-nitro-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(4-methoxyphenyl)sulfonylacetyl]imino-5-nitro-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[2-(4-methoxyphenyl)sulfonylacetyl]imino-5-nitro-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C20H19N3O8S2 MolecularWeight: 493.51016

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CS(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)CN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)CS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H19N3O8S2/c1-3-31-19(25)11-22-16-10-13(23(26)27)4-9-17(16)32-20(22)21-18(24)12-33(28,29)15-7-5-14(30-2)6-8-15/h4-10H,3,11-12H2,1-2H3