2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethyl 1,3-benzodioxole-5-carboxylate

Systemtic Name: 2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethyl 1,3-benzodioxole-5-carboxylate Openeye Name: 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl ester IUPAC Name: 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid 2-(1,1,3-triketo-1,2-benzothiazol-2-yl)ethyl ester Formula: C17H13NO7S MolecularWeight: 375.35262

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)OCCN3C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)OCCN3C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C17H13NO7S/c19-16-12-3-1-2-4-15(12)26(21,22)18(16)7-8-23-17(20)11-5-6-13-14(9-11)25-10-24-13/h1-6,9H,7-8,10H2