ethyl N-(1,3-benzodioxol-5-ylcarbonyl)-N'-pentyl-carbamimidate

Systemtic Name: ethyl N-(1,3-benzodioxol-5-ylcarbonyl)-N'-pentyl-carbamimidate Openeye Name: N-(C-ethoxy-N-pentyl-carbonimidoyl)-1,3-benzodioxole-5-carboxamide CAS Name: N-[1,3-benzodioxol-5-yl(oxo)methyl]-N'-pentylcarbamimidic acid ethyl ester IUPAC Name: ethyl N-(1,3-benzodioxole-5-carbonyl)-N'-pentylcarbamimidate Traditional Name: N-(N-amyl-C-ethoxy-carbonimidoyl)-piperonylamide Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN=C(NC(=O)C1=CC2=C(C=C1)OCO2)OCC

Isomeric SMILES

CCCCCN=C(NC(=O)C1=CC2=C(C=C1)OCO2)OCC

InChI

InChI=1S/C16H22N2O4/c1-3-5-6-9-17-16(20-4-2)18-15(19)12-7-8-13-14(10-12)22-11-21-13/h7-8,10H,3-6,9,11H2,1-2H3,(H,17,18,19)