N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-ethynyl-2,3-dimethoxy-benzamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-ethynyl-2,3-dimethoxy-benzamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-ethynyl-2,3-dimethoxy-benzamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-ethynyl-2,3-dimethoxybenzamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-6-ethynyl-2,3-dimethoxybenzamide Traditional Name: 6-ethynyl-N-homopiperonyl-2,3-dimethoxy-benzamide Formula: C20H19NO5 MolecularWeight: 353.36856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C#C)C(=O)NCCC2=CC3=C(C=C2)OCO3)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C#C)C(=O)NCCC2=CC3=C(C=C2)OCO3)OC

InChI

InChI=1S/C20H19NO5/c1-4-14-6-8-16(23-2)19(24-3)18(14)20(22)21-10-9-13-5-7-15-17(11-13)26-12-25-15/h1,5-8,11H,9-10,12H2,2-3H3,(H,21,22)