N-[[2-(3-methylbutoxy)phenyl]methyl]hexadecan-1-amine

Systemtic Name: N-[[2-(3-methylbutoxy)phenyl]methyl]hexadecan-1-amine Openeye Name: N-[(2-isopentyloxyphenyl)methyl]hexadecan-1-amine CAS Name: N-[[2-(3-methylbutoxy)phenyl]methyl]-1-hexadecanamine IUPAC Name: N-[[2-(3-methylbutoxy)phenyl]methyl]hexadecan-1-amine Traditional Name: cetyl-(2-isoamoxybenzyl)amine Formula: C28H51NO MolecularWeight: 417.71064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNCC1=CC=CC=C1OCCC(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCNCC1=CC=CC=C1OCCC(C)C

InChI

InChI=1S/C28H51NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-23-29-25-27-20-17-18-21-28(27)30-24-22-26(2)3/h17-18,20-21,26,29H,4-16,19,22-25H2,1-3H3