N-[(3-propan-2-yloxyphenyl)methyl]hexadecan-1-amine

Systemtic Name: N-[(3-propan-2-yloxyphenyl)methyl]hexadecan-1-amine Openeye Name: N-[(3-isopropoxyphenyl)methyl]hexadecan-1-amine CAS Name: N-[(3-propan-2-yloxyphenyl)methyl]-1-hexadecanamine IUPAC Name: N-[(3-propan-2-yloxyphenyl)methyl]hexadecan-1-amine Traditional Name: cetyl-(3-isopropoxybenzyl)amine Formula: C26H47NO MolecularWeight: 389.65748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNCC1=CC(=CC=C1)OC(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCNCC1=CC(=CC=C1)OC(C)C

InChI

InChI=1S/C26H47NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-27-23-25-19-18-20-26(22-25)28-24(2)3/h18-20,22,24,27H,4-17,21,23H2,1-3H3