[2-acetyloxy-4-[(E)-2-(8-nitroquinolin-2-yl)ethenyl]phenyl] ethanoate

Systemtic Name: [2-acetyloxy-4-[(E)-2-(8-nitroquinolin-2-yl)ethenyl]phenyl] ethanoate Openeye Name: [2-acetoxy-4-[(E)-2-(8-nitro-2-quinolyl)vinyl]phenyl] acetate CAS Name: acetic acid [2-acetyloxy-4-[(E)-2-(8-nitro-2-quinolinyl)ethenyl]phenyl] ester IUPAC Name: [2-acetyloxy-4-[(E)-2-(8-nitroquinolin-2-yl)ethenyl]phenyl] acetate Traditional Name: acetic acid [2-acetoxy-4-[(E)-2-(8-nitro-2-quinolyl)vinyl]phenyl] ester Formula: C21H16N2O6 MolecularWeight: 392.36154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C=CC2=NC3=C(C=CC=C3[N+](=O)[O-])C=C2)OC(=O)C

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)/C=C/C2=NC3=C(C=CC=C3[N+](=O)[O-])C=C2)OC(=O)C

InChI

InChI=1S/C21H16N2O6/c1-13(24)28-19-11-7-15(12-20(19)29-14(2)25)6-9-17-10-8-16-4-3-5-18(23(26)27)21(16)22-17/h3-12H,1-2H3/b9-6+