4-[(3-fluoranyl-4-undecoxy-phenyl)iminomethyl]benzoic acid

Systemtic Name: 4-[(3-fluoranyl-4-undecoxy-phenyl)iminomethyl]benzoic acid Openeye Name: 4-[(3-fluoro-4-undecoxy-phenyl)iminomethyl]benzoic acid CAS Name: 4-[(3-fluoro-4-undecoxyphenyl)iminomethyl]benzoic acid IUPAC Name: 4-[(3-fluoro-4-undecoxyphenyl)iminomethyl]benzoic acid Traditional Name: 4-[(3-fluoro-4-undecoxy-phenyl)iminomethyl]benzoic acid Formula: C25H32FNO3 MolecularWeight: 413.524883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC1=C(C=C(C=C1)N=CC2=CC=C(C=C2)C(=O)O)F

Isomeric SMILES

CCCCCCCCCCCOC1=C(C=C(C=C1)N=CC2=CC=C(C=C2)C(=O)O)F

InChI

InChI=1S/C25H32FNO3/c1-2-3-4-5-6-7-8-9-10-17-30-24-16-15-22(18-23(24)26)27-19-20-11-13-21(14-12-20)25(28)29/h11-16,18-19H,2-10,17H2,1H3,(H,28,29)