8-[(2E)-2-[(4-fluoranyl-3-phenoxy-phenyl)methylidene]hydrazinyl]-8-oxidanylidene-octanoic acid

Systemtic Name: 8-[(2E)-2-[(4-fluoranyl-3-phenoxy-phenyl)methylidene]hydrazinyl]-8-oxidanylidene-octanoic acid Openeye Name: 8-[(2E)-2-[(4-fluoro-3-phenoxy-phenyl)methylene]hydrazino]-8-oxo-octanoic acid CAS Name: 8-[(2E)-2-[(4-fluoro-3-phenoxyphenyl)methylidene]hydrazinyl]-8-oxooctanoic acid IUPAC Name: 8-[(2E)-2-[(4-fluoro-3-phenoxyphenyl)methylidene]hydrazinyl]-8-oxooctanoic acid Traditional Name: 8-[(N'E)-N'-(4-fluoro-3-phenoxy-benzylidene)hydrazino]-8-keto-caprylic acid Formula: C21H23FN2O4 MolecularWeight: 386.416723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=CC(=C2)C=NNC(=O)CCCCCCC(=O)O)F

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=CC(=C2)/C=N/NC(=O)CCCCCCC(=O)O)F

InChI

InChI=1S/C21H23FN2O4/c22-18-13-12-16(14-19(18)28-17-8-4-3-5-9-17)15-23-24-20(25)10-6-1-2-7-11-21(26)27/h3-5,8-9,12-15H,1-2,6-7,10-11H2,(H,24,25)(H,26,27)/b23-15+