2-[3-fluoranyl-4-[(E)-6-oxidanylhept-1-enyl]phenyl]-4H-quinoxalin-6-one

Systemtic Name: 2-[3-fluoranyl-4-[(E)-6-oxidanylhept-1-enyl]phenyl]-4H-quinoxalin-6-one Openeye Name: 2-[3-fluoro-4-[(E)-6-hydroxyhept-1-enyl]phenyl]-4H-quinoxalin-6-one CAS Name: 2-[3-fluoro-4-[(E)-6-hydroxyhept-1-enyl]phenyl]-4H-quinoxalin-6-one IUPAC Name: 2-[3-fluoro-4-[(E)-6-hydroxyhept-1-enyl]phenyl]-4H-quinoxalin-6-one Traditional Name: 2-[3-fluoro-4-[(E)-6-hydroxyhept-1-enyl]phenyl]-4H-quinoxalin-6-one Formula: C21H21FN2O2 MolecularWeight: 352.402043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC=CC1=C(C=C(C=C1)C2=CNC3=CC(=O)C=CC3=N2)F)O

Isomeric SMILES

CC(CCC/C=C/C1=C(C=C(C=C1)C2=CNC3=CC(=O)C=CC3=N2)F)O

InChI

InChI=1S/C21H21FN2O2/c1-14(25)5-3-2-4-6-15-7-8-16(11-18(15)22)21-13-23-20-12-17(26)9-10-19(20)24-21/h4,6-14,23,25H,2-3,5H2,1H3/b6-4+