N-[2-(2-butan-2-ylphenoxy)propyl]hexadecan-1-amine

Systemtic Name: N-[2-(2-butan-2-ylphenoxy)propyl]hexadecan-1-amine Openeye Name: N-[2-(2-sec-butylphenoxy)propyl]hexadecan-1-amine CAS Name: N-[2-(2-butan-2-ylphenoxy)propyl]-1-hexadecanamine IUPAC Name: N-[2-(2-butan-2-ylphenoxy)propyl]hexadecan-1-amine Traditional Name: cetyl-[2-(2-sec-butylphenoxy)propyl]amine Formula: C29H53NO MolecularWeight: 431.73722

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNCC(C)OC1=CC=CC=C1C(C)CC

Isomeric SMILES

CCCCCCCCCCCCCCCCNCC(C)OC1=CC=CC=C1C(C)CC

InChI

InChI=1S/C29H53NO/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-21-24-30-25-27(4)31-29-23-20-19-22-28(29)26(3)6-2/h19-20,22-23,26-27,30H,5-18,21,24-25H2,1-4H3