ethyl 2-[2-[2-(4-chloranylphenoxy)ethanoylimino]-6-methylsulfonyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(4-chloranylphenoxy)ethanoylimino]-6-methylsulfonyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-[2-(4-chlorophenoxy)acetyl]imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[2-(4-chlorophenoxy)-1-oxoethyl]imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(4-chlorophenoxy)acetyl]imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[2-(4-chlorophenoxy)acetyl]imino-6-mesyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C20H19ClN2O6S2 MolecularWeight: 482.95766

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)COC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)COC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H19ClN2O6S2/c1-3-28-19(25)11-23-16-9-8-15(31(2,26)27)10-17(16)30-20(23)22-18(24)12-29-14-6-4-13(21)5-7-14/h4-10H,3,11-12H2,1-2H3