(4-nitrophenyl)methyl-[(1S)-1-pyridin-2-ylethyl]azanium

Systemtic Name: (4-nitrophenyl)methyl-[(1S)-1-pyridin-2-ylethyl]azanium Openeye Name: (4-nitrophenyl)methyl-[(1S)-1-(2-pyridyl)ethyl]ammonium CAS Name: (4-nitrophenyl)methyl-[(1S)-1-(2-pyridinyl)ethyl]ammonium IUPAC Name: (4-nitrophenyl)methyl-[(1S)-1-pyridin-2-ylethyl]azanium Traditional Name: (4-nitrobenzyl)-[(1S)-1-(2-pyridyl)ethyl]ammonium Formula: C14H16N3O2+ MolecularWeight: 258.29574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=N1)[NH2+]CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C1=CC=CC=N1)[NH2+]CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

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