2-[2-[[2-(1,3-benzodioxol-5-yl)ethylamino]methyl]phenoxy]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[2-[[2-(1,3-benzodioxol-5-yl)ethylamino]methyl]phenoxy]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[2-[[2-(1,3-benzodioxol-5-yl)ethylamino]methyl]phenoxy]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[2-[[2-(1,3-benzodioxol-5-yl)ethylamino]methyl]phenoxy]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[2-[[2-(1,3-benzodioxol-5-yl)ethylamino]methyl]phenoxy]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[2-[(homopiperonylamino)methyl]phenoxy]-1-pyrrolidino-ethanone Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)COC2=CC=CC=C2CNCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCN(C1)C(=O)COC2=CC=CC=C2CNCCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H26N2O4/c25-22(24-11-3-4-12-24)15-26-19-6-2-1-5-18(19)14-23-10-9-17-7-8-20-21(13-17)28-16-27-20/h1-2,5-8,13,23H,3-4,9-12,14-16H2