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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH2+]CC1COC2=CC=CC=C2O1)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C[NH2+]C[C@H]1COC2=CC=CC=C2O1)C3=CC=CC=C3

InChI

InChI=1S/C18H21NO2/c1-14(15-7-3-2-4-8-15)11-19-12-16-13-20-17-9-5-6-10-18(17)21-16/h2-10,14,16,19H,11-13H2,1H3/p+1/t14-,16+/m1/s1