N'-[(E)-3-[4-(azepan-1-yl)phenyl]prop-2-enoyl]-4-fluoranyl-benzohydrazide

Systemtic Name: N'-[(E)-3-[4-(azepan-1-yl)phenyl]prop-2-enoyl]-4-fluoranyl-benzohydrazide Openeye Name: N'-[(E)-3-[4-(azepan-1-yl)phenyl]prop-2-enoyl]-4-fluoro-benzohydrazide CAS Name: N'-[(E)-3-[4-(1-azepanyl)phenyl]-1-oxoprop-2-enyl]-4-fluorobenzohydrazide IUPAC Name: N'-[(E)-3-[4-(azepan-1-yl)phenyl]prop-2-enoyl]-4-fluorobenzohydrazide Traditional Name: N'-[(E)-3-[4-(azepan-1-yl)phenyl]acryloyl]-4-fluoro-benzohydrazide Formula: C22H24FN3O2 MolecularWeight: 381.443263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)C=CC(=O)NNC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)/C=C/C(=O)NNC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H24FN3O2/c23-19-10-8-18(9-11-19)22(28)25-24-21(27)14-7-17-5-12-20(13-6-17)26-15-3-1-2-4-16-26/h5-14H,1-4,15-16H2,(H,24,27)(H,25,28)/b14-7+