[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(1S)-1-phenylpropyl]azanium

Systemtic Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(1S)-1-phenylpropyl]azanium Openeye Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(1S)-1-phenylpropyl]ammonium CAS Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(1S)-1-phenylpropyl]ammonium IUPAC Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(1S)-1-phenylpropyl]azanium Traditional Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(1S)-1-phenylpropyl]ammonium Formula: C18H22NO2+ MolecularWeight: 284.37278

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)[NH2+]CC2COC3=CC=CC=C3O2

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)[NH2+]C[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C18H21NO2/c1-2-16(14-8-4-3-5-9-14)19-12-15-13-20-17-10-6-7-11-18(17)21-15/h3-11,15-16,19H,2,12-13H2,1H3/p+1/t15-,16-/m0/s1