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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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