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

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(2S)-4-methylpentan-2-yl]azanium Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S)-1,3-dimethylbutyl]ammonium CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(2S)-4-methylpentan-2-yl]ammonium IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(2S)-4-methylpentan-2-yl]azanium Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S)-1,3-dimethylbutyl]ammonium Formula: C16H26NO2+ MolecularWeight: 264.38314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25NO2/c1-12(2)10-13(3)17-7-6-14-4-5-15-16(11-14)19-9-8-18-15/h4-5,11-13,17H,6-10H2,1-3H3/p+1/t13-/m0/s1