(3-nitrophenyl)methyl-[(1S)-1-pyridin-3-ylethyl]azanium

Systemtic Name: (3-nitrophenyl)methyl-[(1S)-1-pyridin-3-ylethyl]azanium Openeye Name: (3-nitrophenyl)methyl-[(1S)-1-(3-pyridyl)ethyl]ammonium CAS Name: (3-nitrophenyl)methyl-[(1S)-1-(3-pyridinyl)ethyl]ammonium IUPAC Name: (3-nitrophenyl)methyl-[(1S)-1-pyridin-3-ylethyl]azanium Traditional Name: (3-nitrobenzyl)-[(1S)-1-(3-pyridyl)ethyl]ammonium Formula: C14H16N3O2+ MolecularWeight: 258.29574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN=CC=C1)[NH2+]CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C1=CN=CC=C1)[NH2+]CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H15N3O2/c1-11(13-5-3-7-15-10-13)16-9-12-4-2-6-14(8-12)17(18)19/h2-8,10-11,16H,9H2,1H3/p+1/t11-/m0/s1