3-fluoranyl-4-[[(4E)-pentadeca-4,14-dienyl]amino]benzoic acid

Systemtic Name: 3-fluoranyl-4-[[(4E)-pentadeca-4,14-dienyl]amino]benzoic acid Openeye Name: 3-fluoro-4-[[(4E)-pentadeca-4,14-dienyl]amino]benzoic acid CAS Name: 3-fluoro-4-[[(4E)-pentadeca-4,14-dienyl]amino]benzoic acid IUPAC Name: 3-fluoro-4-[[(4E)-pentadeca-4,14-dienyl]amino]benzoic acid Traditional Name: 3-fluoro-4-[[(4E)-pentadeca-4,14-dienyl]amino]benzoic acid Formula: C22H32FNO2 MolecularWeight: 361.493383

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCCCCCC=CCCCNC1=C(C=C(C=C1)C(=O)O)F

Isomeric SMILES

C=CCCCCCCCC/C=C/CCCNC1=C(C=C(C=C1)C(=O)O)F

InChI

InChI=1S/C22H32FNO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-24-21-16-15-19(22(25)26)18-20(21)23/h2,11-12,15-16,18,24H,1,3-10,13-14,17H2,(H,25,26)/b12-11+