4-[2-(6-nitroindazol-1-yl)ethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-(6-nitroindazol-1-yl)ethoxy]benzenecarbonitrile Openeye Name: 4-[2-(6-nitroindazol-1-yl)ethoxy]benzonitrile CAS Name: 4-[2-(6-nitro-1-indazolyl)ethoxy]benzonitrile IUPAC Name: 4-[2-(6-nitroindazol-1-yl)ethoxy]benzonitrile Traditional Name: 4-[2-(6-nitroindazol-1-yl)ethoxy]benzonitrile Formula: C16H12N4O3 MolecularWeight: 308.29148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OCCN2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2

Isomeric SMILES

C1=CC(=CC=C1C#N)OCCN2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2

InChI

InChI=1S/C16H12N4O3/c17-10-12-1-5-15(6-2-12)23-8-7-19-16-9-14(20(21)22)4-3-13(16)11-18-19/h1-6,9,11H,7-8H2