1-benzofuran-2-ylmethyl-[(1S)-1-pyridin-4-ylethyl]azanium

Systemtic Name: 1-benzofuran-2-ylmethyl-[(1S)-1-pyridin-4-ylethyl]azanium Openeye Name: benzofuran-2-ylmethyl-[(1S)-1-(4-pyridyl)ethyl]ammonium CAS Name: 2-benzofuranylmethyl-[(1S)-1-pyridin-4-ylethyl]ammonium IUPAC Name: 1-benzofuran-2-ylmethyl-[(1S)-1-pyridin-4-ylethyl]azanium Traditional Name: benzofuran-2-ylmethyl-[(1S)-1-(4-pyridyl)ethyl]ammonium Formula: C16H17N2O+ MolecularWeight: 253.31898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=NC=C1)[NH2+]CC2=CC3=CC=CC=C3O2

Isomeric SMILES

C[C@@H](C1=CC=NC=C1)[NH2+]CC2=CC3=CC=CC=C3O2

InChI

InChI=1S/C16H16N2O/c1-12(13-6-8-17-9-7-13)18-11-15-10-14-4-2-3-5-16(14)19-15/h2-10,12,18H,11H2,1H3/p+1/t12-/m0/s1