(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-1-ium

Systemtic Name: (3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-1-ium Openeye Name: (3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-1-ium CAS Name: (3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-1-ium IUPAC Name: (3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-1-ium Traditional Name: (3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperidin-1-ium Formula: C14H20NO2+ MolecularWeight: 234.3141

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)CC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1C[C@H](C[NH2+]C1)CC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C14H19NO2/c1-2-12(10-15-5-1)8-11-3-4-13-14(9-11)17-7-6-16-13/h3-4,9,12,15H,1-2,5-8,10H2/p+1/t12-/m0/s1