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

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S)-1-phenylethyl]azanium Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S)-1-phenylethyl]ammonium CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S)-1-phenylethyl]ammonium IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S)-1-phenylethyl]azanium Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S)-1-phenylethyl]ammonium Formula: C18H22NO2+ MolecularWeight: 284.37278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO2/c1-14(16-5-3-2-4-6-16)19-10-9-15-7-8-17-18(13-15)21-12-11-20-17/h2-8,13-14,19H,9-12H2,1H3/p+1/t14-/m0/s1