N-hexadecyl-1-(2-methylphenoxy)piperidin-4-amine

Systemtic Name: N-hexadecyl-1-(2-methylphenoxy)piperidin-4-amine Openeye Name: N-hexadecyl-1-(2-methylphenoxy)piperidin-4-amine CAS Name: N-hexadecyl-1-(2-methylphenoxy)-4-piperidinamine IUPAC Name: N-hexadecyl-1-(2-methylphenoxy)piperidin-4-amine Traditional Name: cetyl-[1-(2-methylphenoxy)-4-piperidyl]amine Formula: C28H50N2O MolecularWeight: 430.7094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1CCN(CC1)OC2=CC=CC=C2C

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1CCN(CC1)OC2=CC=CC=C2C

InChI

InChI=1S/C28H50N2O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-23-29-27-21-24-30(25-22-27)31-28-20-17-16-19-26(28)2/h16-17,19-20,27,29H,3-15,18,21-25H2,1-2H3