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

Systemtic Name: ethyl 2-[2-[2-(4-chloranylphenoxy)ethanoylimino]-6-ethoxy-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-[2-(4-chlorophenoxy)acetyl]imino-6-ethoxy-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[2-(4-chlorophenoxy)-1-oxoethyl]imino-6-ethoxy-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(4-chlorophenoxy)acetyl]imino-6-ethoxy-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[2-(4-chlorophenoxy)acetyl]imino-6-ethoxy-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C21H21ClN2O5S MolecularWeight: 448.91984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=NC(=O)COC3=CC=C(C=C3)Cl)S2)CC(=O)OCC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=NC(=O)COC3=CC=C(C=C3)Cl)S2)CC(=O)OCC

InChI

InChI=1S/C21H21ClN2O5S/c1-3-27-16-9-10-17-18(11-16)30-21(24(17)12-20(26)28-4-2)23-19(25)13-29-15-7-5-14(22)6-8-15/h5-11H,3-4,12-13H2,1-2H3