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

Systemtic Name: methyl 8-[(2E)-2-[(4-fluoranyl-3-phenoxy-phenyl)methylidene]hydrazinyl]-8-oxidanylidene-octanoate Openeye Name: methyl 8-[(2E)-2-[(4-fluoro-3-phenoxy-phenyl)methylene]hydrazino]-8-oxo-octanoate CAS Name: 8-[(2E)-2-[(4-fluoro-3-phenoxyphenyl)methylidene]hydrazinyl]-8-oxooctanoic acid methyl ester IUPAC Name: methyl 8-[(2E)-2-[(4-fluoro-3-phenoxyphenyl)methylidene]hydrazinyl]-8-oxooctanoate Traditional Name: 8-[(N'E)-N'-(4-fluoro-3-phenoxy-benzylidene)hydrazino]-8-keto-caprylic acid methyl ester Formula: C22H25FN2O4 MolecularWeight: 400.443303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCC(=O)NN=CC1=CC(=C(C=C1)F)OC2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C22H25FN2O4/c1-28-22(27)12-8-3-2-7-11-21(26)25-24-16-17-13-14-19(23)20(15-17)29-18-9-5-4-6-10-18/h4-6,9-10,13-16H,2-3,7-8,11-12H2,1H3,(H,25,26)/b24-16+