N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(1,3-dithiolan-2-yl)-2-methoxy-phenoxy]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(1,3-dithiolan-2-yl)-2-methoxy-phenoxy]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(1,3-dithiolan-2-yl)-2-methoxy-phenoxy]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(1,3-dithiolan-2-yl)-2-methoxyphenoxy]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(1,3-dithiolan-2-yl)-2-methoxyphenoxy]acetamide Traditional Name: 2-[4-(1,3-dithiolan-2-yl)-2-methoxy-phenoxy]-N-piperonyl-acetamide Formula: C20H21NO5S2 MolecularWeight: 419.51444

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2SCCS2)OCC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=C(C=CC(=C1)C2SCCS2)OCC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21NO5S2/c1-23-17-9-14(20-27-6-7-28-20)3-5-15(17)24-11-19(22)21-10-13-2-4-16-18(8-13)26-12-25-16/h2-5,8-9,20H,6-7,10-12H2,1H3,(H,21,22)