N'-(8-nitroisoquinolin-5-yl)propane-1,3-diamine

Systemtic Name: N'-(8-nitroisoquinolin-5-yl)propane-1,3-diamine Openeye Name: N'-(8-nitro-5-isoquinolyl)propane-1,3-diamine CAS Name: N'-(8-nitro-5-isoquinolinyl)propane-1,3-diamine IUPAC Name: N'-(8-nitroisoquinolin-5-yl)propane-1,3-diamine Traditional Name: 3-aminopropyl-(8-nitro-5-isoquinolyl)amine Formula: C12H14N4O2 MolecularWeight: 246.26516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=NC=CC2=C1NCCCN)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C2C=NC=CC2=C1NCCCN)[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O2/c13-5-1-6-15-11-2-3-12(16(17)18)10-8-14-7-4-9(10)11/h2-4,7-8,15H,1,5-6,13H2