(5E,9Z,13E)-9-fluoranyl-5,13-dimethyl-18-phenyl-octadeca-5,9,13-trien-17-ynenitrile

Systemtic Name: (5E,9Z,13E)-9-fluoranyl-5,13-dimethyl-18-phenyl-octadeca-5,9,13-trien-17-ynenitrile Openeye Name: (5E,9Z,13E)-9-fluoro-5,13-dimethyl-18-phenyl-octadeca-5,9,13-trien-17-ynenitrile CAS Name: (5E,9Z,13E)-9-fluoro-5,13-dimethyl-18-phenyloctadeca-5,9,13-trien-17-ynenitrile IUPAC Name: (5E,9Z,13E)-9-fluoro-5,13-dimethyl-18-phenyloctadeca-5,9,13-trien-17-ynenitrile Traditional Name: (5E,9Z,13E)-9-fluoro-5,13-dimethyl-18-phenyl-octadeca-5,9,13-trien-17-ynenitrile Formula: C26H32FN MolecularWeight: 377.537383

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCCC(=CCCC#CC1=CC=CC=C1)C)F)CCCC#N

Isomeric SMILES

C/C(=C\CC/C(=C/CC/C(=C/CCC#CC1=CC=CC=C1)/C)/F)/CCCC#N

InChI

InChI=1S/C26H32FN/c1-23(13-5-3-6-17-25-18-7-4-8-19-25)15-11-20-26(27)21-12-16-24(2)14-9-10-22-28/h4,7-8,13,16,18-20H,3,5,9-12,14-15,21H2,1-2H3/b23-13+,24-16+,26-20-