N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C15H21N2O3+ MolecularWeight: 277.33884

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(=O)NCC2COC3=CC=CC=C3O2

Isomeric SMILES

C1CC[NH+](C1)CC(=O)NC[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C15H20N2O3/c18-15(10-17-7-3-4-8-17)16-9-12-11-19-13-5-1-2-6-14(13)20-12/h1-2,5-6,12H,3-4,7-11H2,(H,16,18)/p+1/t12-/m0/s1