[2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 1,3-benzodioxole-5-carboxylate Openeye Name: [2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxo-ethyl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxoethyl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [2-[2-(2,4-dichlorophenyl)ethylamino]-2-keto-ethyl] ester Formula: C18H15Cl2NO5 MolecularWeight: 396.2214

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)OCC(=O)NCCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)OCC(=O)NCCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H15Cl2NO5/c19-13-3-1-11(14(20)8-13)5-6-21-17(22)9-24-18(23)12-2-4-15-16(7-12)26-10-25-15/h1-4,7-8H,5-6,9-10H2,(H,21,22)