[(1S)-1-[5-(pyridin-4-ylmethylcarbamoyl)furan-2-yl]ethyl]azanium

Systemtic Name: [(1S)-1-[5-(pyridin-4-ylmethylcarbamoyl)furan-2-yl]ethyl]azanium Openeye Name: [(1S)-1-[5-(4-pyridylmethylcarbamoyl)-2-furyl]ethyl]ammonium CAS Name: [(1S)-1-[5-[oxo-(pyridin-4-ylmethylamino)methyl]-2-furanyl]ethyl]ammonium IUPAC Name: [(1S)-1-[5-(pyridin-4-ylmethylcarbamoyl)furan-2-yl]ethyl]azanium Traditional Name: [(1S)-1-[5-(4-pyridylmethylcarbamoyl)-2-furyl]ethyl]ammonium Formula: C13H16N3O2+ MolecularWeight: 246.28504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(O1)C(=O)NCC2=CC=NC=C2)[NH3+]

Isomeric SMILES

C[C@@H](C1=CC=C(O1)C(=O)NCC2=CC=NC=C2)[NH3+]

InChI

InChI=1S/C13H15N3O2/c1-9(14)11-2-3-12(18-11)13(17)16-8-10-4-6-15-7-5-10/h2-7,9H,8,14H2,1H3,(H,16,17)/p+1/t9-/m0/s1