2-[4-[(E)-2-(8-nitroquinolin-2-yl)ethenyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(E)-2-(8-nitroquinolin-2-yl)ethenyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[(E)-2-(8-nitro-2-quinolyl)vinyl]phenoxy]acetonitrile CAS Name: 2-[4-[(E)-2-(8-nitro-2-quinolinyl)ethenyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[(E)-2-(8-nitroquinolin-2-yl)ethenyl]phenoxy]acetonitrile Traditional Name: 2-[4-[(E)-2-(8-nitro-2-quinolyl)vinyl]phenoxy]acetonitrile Formula: C19H13N3O3 MolecularWeight: 331.32482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)[N+](=O)[O-])N=C(C=C2)C=CC3=CC=C(C=C3)OCC#N

Isomeric SMILES

C1=CC2=C(C(=C1)[N+](=O)[O-])N=C(C=C2)/C=C/C3=CC=C(C=C3)OCC#N

InChI

InChI=1S/C19H13N3O3/c20-12-13-25-17-10-5-14(6-11-17)4-8-16-9-7-15-2-1-3-18(22(23)24)19(15)21-16/h1-11H,13H2/b8-4+