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

Systemtic Name: N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]acetamide CAS Name: N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-[(2S)-2-phenyl-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]acetamide Formula: C21H25N2O3+ MolecularWeight: 353.4348

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC(=O)NCC2COC3=CC=CC=C3O2)C4=CC=CC=C4

Isomeric SMILES

C1C[C@H]([NH+](C1)CC(=O)NC[C@@H]2COC3=CC=CC=C3O2)C4=CC=CC=C4

InChI

InChI=1S/C21H24N2O3/c24-21(14-23-12-6-9-18(23)16-7-2-1-3-8-16)22-13-17-15-25-19-10-4-5-11-20(19)26-17/h1-5,7-8,10-11,17-18H,6,9,12-15H2,(H,22,24)/p+1/t17-,18+/m1/s1