1-[2-(1,3-benzodioxol-5-yloxymethyl)morpholin-4-yl]-2-(3,4-dimethoxyphenyl)sulfanyl-ethanone

Systemtic Name: 1-[2-(1,3-benzodioxol-5-yloxymethyl)morpholin-4-yl]-2-(3,4-dimethoxyphenyl)sulfanyl-ethanone Openeye Name: 1-[2-(1,3-benzodioxol-5-yloxymethyl)morpholin-4-yl]-2-(3,4-dimethoxyphenyl)sulfanyl-ethanone CAS Name: 1-[2-(1,3-benzodioxol-5-yloxymethyl)-4-morpholinyl]-2-[(3,4-dimethoxyphenyl)thio]ethanone IUPAC Name: 1-[2-(1,3-benzodioxol-5-yloxymethyl)morpholin-4-yl]-2-(3,4-dimethoxyphenyl)sulfanylethanone Traditional Name: 1-[2-(1,3-benzodioxol-5-yloxymethyl)morpholino]-2-[(3,4-dimethoxyphenyl)thio]ethanone Formula: C22H25NO7S MolecularWeight: 447.5014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SCC(=O)N2CCOC(C2)COC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)SCC(=O)N2CCOC(C2)COC3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C22H25NO7S/c1-25-18-6-4-17(10-20(18)26-2)31-13-22(24)23-7-8-27-16(11-23)12-28-15-3-5-19-21(9-15)30-14-29-19/h3-6,9-10,16H,7-8,11-14H2,1-2H3