2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(2S)-pentan-2-yl]azanium

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(2S)-pentan-2-yl]azanium Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S)-1-methylbutyl]ammonium CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(2S)-pentan-2-yl]ammonium IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(2S)-pentan-2-yl]azanium Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S)-1-methylbutyl]ammonium Formula: C15H24NO2+ MolecularWeight: 250.35656

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)[NH2+]CCC1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CCC[C@H](C)[NH2+]CCC1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C15H23NO2/c1-3-4-12(2)16-8-7-13-5-6-14-15(11-13)18-10-9-17-14/h5-6,11-12,16H,3-4,7-10H2,1-2H3/p+1/t12-/m0/s1