N3-(8-nitroisoquinolin-5-yl)benzene-1,3-diamine

Systemtic Name: N3-(8-nitroisoquinolin-5-yl)benzene-1,3-diamine Openeye Name: N3-(8-nitro-5-isoquinolyl)benzene-1,3-diamine CAS Name: N3-(8-nitro-5-isoquinolinyl)benzene-1,3-diamine IUPAC Name: 3-N-(8-nitroisoquinolin-5-yl)benzene-1,3-diamine Traditional Name: (3-aminophenyl)-(8-nitro-5-isoquinolyl)amine Formula: C15H12N4O2 MolecularWeight: 280.28138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=CC(=C1)NC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-])N

InChI

InChI=1S/C15H12N4O2/c16-10-2-1-3-11(8-10)18-14-4-5-15(19(20)21)13-9-17-7-6-12(13)14/h1-9,18H,16H2