N-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-(1,1-diethylprop-2-ynylamino)-2-oxo-ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-(1,1-diethylprop-2-ynylamino)-2-keto-ethyl]-piperonylamide Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)CNC(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCC(CC)(C#C)NC(=O)CNC(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C17H20N2O4/c1-4-17(5-2,6-3)19-15(20)10-18-16(21)12-7-8-13-14(9-12)23-11-22-13/h1,7-9H,5-6,10-11H2,2-3H3,(H,18,21)(H,19,20)