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

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S)-1-pyridin-3-ylethyl]azanium Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S)-1-(3-pyridyl)ethyl]ammonium CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S)-1-(3-pyridinyl)ethyl]ammonium IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S)-1-pyridin-3-ylethyl]azanium Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(1S)-1-(3-pyridyl)ethyl]ammonium Formula: C17H21N2O2+ MolecularWeight: 285.36084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O2/c1-13(15-3-2-7-18-12-15)19-8-6-14-4-5-16-17(11-14)21-10-9-20-16/h2-5,7,11-13,19H,6,8-10H2,1H3/p+1/t13-/m0/s1