(4-nitrophenyl)methyl-[2-(pyridin-3-ylcarbonylamino)ethyl]azanium

Systemtic Name: (4-nitrophenyl)methyl-[2-(pyridin-3-ylcarbonylamino)ethyl]azanium Openeye Name: (4-nitrophenyl)methyl-[2-(pyridine-3-carbonylamino)ethyl]ammonium CAS Name: (4-nitrophenyl)methyl-[2-[[oxo(3-pyridinyl)methyl]amino]ethyl]ammonium IUPAC Name: (4-nitrophenyl)methyl-[2-(pyridine-3-carbonylamino)ethyl]azanium Traditional Name: 2-nicotinamidoethyl-(4-nitrobenzyl)ammonium Formula: C15H17N4O3+ MolecularWeight: 301.32048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N4O3/c20-15(13-2-1-7-16-11-13)18-9-8-17-10-12-3-5-14(6-4-12)19(21)22/h1-7,11,17H,8-10H2,(H,18,20)/p+1