[2-oxidanylidene-2-[(2-phenylsulfanylphenyl)amino]ethyl] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(2-phenylsulfanylphenyl)amino]ethyl] 1,3-benzodioxole-5-carboxylate Openeye Name: [2-oxo-2-(2-phenylsulfanylanilino)ethyl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [2-oxo-2-[2-(phenylthio)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylanilino)ethyl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [2-keto-2-[2-(phenylthio)anilino]ethyl] ester Formula: C22H17NO5S MolecularWeight: 407.43908

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)OCC(=O)NC3=CC=CC=C3SC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)OCC(=O)NC3=CC=CC=C3SC4=CC=CC=C4

InChI

InChI=1S/C22H17NO5S/c24-21(13-26-22(25)15-10-11-18-19(12-15)28-14-27-18)23-17-8-4-5-9-20(17)29-16-6-2-1-3-7-16/h1-12H,13-14H2,(H,23,24)