N-[(E)-isoquinolin-3-ylmethylideneamino]-5-nitro-pyridin-2-amine

Systemtic Name: N-[(E)-isoquinolin-3-ylmethylideneamino]-5-nitro-pyridin-2-amine Openeye Name: N-[(E)-3-isoquinolylmethyleneamino]-5-nitro-pyridin-2-amine CAS Name: N-[(E)-3-isoquinolinylmethylideneamino]-5-nitro-2-pyridinamine IUPAC Name: N-[(E)-isoquinolin-3-ylmethylideneamino]-5-nitropyridin-2-amine Traditional Name: [(E)-3-isoquinolylmethyleneamino]-(5-nitro-2-pyridyl)amine Formula: C15H11N5O2 MolecularWeight: 293.28014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=NC(=CC2=C1)C=NNC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C=NC(=CC2=C1)/C=N/NC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H11N5O2/c21-20(22)14-5-6-15(17-10-14)19-18-9-13-7-11-3-1-2-4-12(11)8-16-13/h1-10H,(H,17,19)/b18-9+