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

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S,3S)-3-methylcyclohexyl]azanium Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S,3S)-3-methylcyclohexyl]ammonium CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S,3S)-3-methylcyclohexyl]ammonium IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S,3S)-3-methylcyclohexyl]azanium Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S,3S)-3-methylcyclohexyl]ammonium Formula: C17H26NO2+ MolecularWeight: 276.39384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)[NH2+]CCC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C[C@H]1CCC[C@@H](C1)[NH2+]CCC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C17H25NO2/c1-13-3-2-4-15(11-13)18-8-7-14-5-6-16-17(12-14)20-10-9-19-16/h5-6,12-13,15,18H,2-4,7-11H2,1H3/p+1/t13-,15-/m0/s1