methyl 2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylimino)-3-ethyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylimino)-3-ethyl-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-(2,3-dihydro-1,4-benzodioxine-6-carbonylimino)-3-ethyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]imino-3-ethyl-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(2,3-dihydro-1,4-benzodioxine-6-carbonylimino)-3-ethyl-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-carbonylimino)-3-ethyl-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C20H18N2O5S MolecularWeight: 398.43232

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H18N2O5S/c1-3-22-14-6-4-13(19(24)25-2)11-17(14)28-20(22)21-18(23)12-5-7-15-16(10-12)27-9-8-26-15/h4-7,10-11H,3,8-9H2,1-2H3