[2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 7-chloranyl-1,3-benzodioxole-5-carboxylate

Systemtic Name: [2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 7-chloranyl-1,3-benzodioxole-5-carboxylate Openeye Name: [2-(2,6-dimethyl-1-piperidyl)-2-oxo-ethyl] 7-chloro-1,3-benzodioxole-5-carboxylate CAS Name: 7-chloro-1,3-benzodioxole-5-carboxylic acid [2-(2,6-dimethyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl] 7-chloro-1,3-benzodioxole-5-carboxylate Traditional Name: 7-chloro-piperonylic acid [2-(2,6-dimethylpiperidino)-2-keto-ethyl] ester Formula: C17H20ClNO5 MolecularWeight: 353.7974

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)COC(=O)C2=CC3=C(C(=C2)Cl)OCO3)C

Isomeric SMILES

CC1CCCC(N1C(=O)COC(=O)C2=CC3=C(C(=C2)Cl)OCO3)C

InChI

InChI=1S/C17H20ClNO5/c1-10-4-3-5-11(2)19(10)15(20)8-22-17(21)12-6-13(18)16-14(7-12)23-9-24-16/h6-7,10-11H,3-5,8-9H2,1-2H3