1-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]piperidin-1-ium-4-one

Systemtic Name: 1-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]piperidin-1-ium-4-one Openeye Name: 1-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]piperidin-1-ium-4-one CAS Name: 1-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-piperidin-1-iumone IUPAC Name: 1-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]piperidin-1-ium-4-one Traditional Name: 1-[(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]piperidin-1-ium-4-one Formula: C15H20NO3+ MolecularWeight: 262.3242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)[NH+]3CCC(=O)CC3

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)OCCO2)[NH+]3CCC(=O)CC3

InChI

InChI=1S/C15H19NO3/c1-11(16-6-4-13(17)5-7-16)12-2-3-14-15(10-12)19-9-8-18-14/h2-3,10-11H,4-9H2,1H3/p+1/t11-/m0/s1