dodecan-1-amine; (2Z,4E,6E)-7-fluoranyl-2-(4-methylphenyl)hepta-2,4,6-trienenitrile

Systemtic Name: dodecan-1-amine; (2Z,4E,6E)-7-fluoranyl-2-(4-methylphenyl)hepta-2,4,6-trienenitrile Openeye Name: dodecan-1-amine; (2Z,4E,6E)-7-fluoro-2-(p-tolyl)hepta-2,4,6-trienenitrile CAS Name: 1-dodecanamine; (2Z,4E,6E)-7-fluoro-2-(4-methylphenyl)hepta-2,4,6-trienenitrile IUPAC Name: dodecan-1-amine; (2Z,4E,6E)-7-fluoro-2-(4-methylphenyl)hepta-2,4,6-trienenitrile Traditional Name: (2Z,4E,6E)-7-fluoro-2-(p-tolyl)hepta-2,4,6-trienenitrile; laurylamine Formula: C26H39FN2 MolecularWeight: 398.599663

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN.CC1=CC=C(C=C1)C(=CC=CC=CF)C#N

Isomeric SMILES

CCCCCCCCCCCCN.CC1=CC=C(C=C1)/C(=C/C=C/C=C/F)/C#N

InChI

InChI=1S/C14H12FN.C12H27N/c1-12-6-8-13(9-7-12)14(11-16)5-3-2-4-10-15;1-2-3-4-5-6-7-8-9-10-11-12-13/h2-10H,1H3;2-13H2,1H3/b3-2+,10-4+,14-5+;