12-(methylcarbamoyloxy)dodecyl 1,3-benzodioxole-5-carboxylate

Systemtic Name: 12-(methylcarbamoyloxy)dodecyl 1,3-benzodioxole-5-carboxylate Openeye Name: 12-(methylcarbamoyloxy)dodecyl 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid 12-(methylcarbamoyloxy)dodecyl ester IUPAC Name: 12-(methylcarbamoyloxy)dodecyl 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid 12-(methylcarbamoyloxy)dodecyl ester Formula: C22H33NO6 MolecularWeight: 407.50052

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)OCCCCCCCCCCCCOC(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CNC(=O)OCCCCCCCCCCCCOC(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C22H33NO6/c1-23-22(25)27-15-11-9-7-5-3-2-4-6-8-10-14-26-21(24)18-12-13-19-20(16-18)29-17-28-19/h12-13,16H,2-11,14-15,17H2,1H3,(H,23,25)