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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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