ethyl 2-[4-ethoxy-2-(2-phenoxyethanoylimino)-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[4-ethoxy-2-(2-phenoxyethanoylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[4-ethoxy-2-(2-phenoxyacetyl)imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[4-ethoxy-2-(1-oxo-2-phenoxyethyl)imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-ethoxy-2-(2-phenoxyacetyl)imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[4-ethoxy-2-(2-phenoxyacetyl)imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=NC(=O)COC3=CC=CC=C3)N2CC(=O)OCC

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=NC(=O)COC3=CC=CC=C3)N2CC(=O)OCC

InChI

InChI=1S/C21H22N2O5S/c1-3-26-16-11-8-12-17-20(16)23(13-19(25)27-4-2)21(29-17)22-18(24)14-28-15-9-6-5-7-10-15/h5-12H,3-4,13-14H2,1-2H3