3-[(4-chlorophenyl)methyl-hexadecyl-amino]propane-1,2-diol

Systemtic Name: 3-[(4-chlorophenyl)methyl-hexadecyl-amino]propane-1,2-diol Openeye Name: 3-[(4-chlorophenyl)methyl-hexadecyl-amino]propane-1,2-diol CAS Name: 3-[(4-chlorophenyl)methyl-hexadecylamino]propane-1,2-diol IUPAC Name: 3-[(4-chlorophenyl)methyl-hexadecylamino]propane-1,2-diol Traditional Name: 3-[cetyl-(4-chlorobenzyl)amino]propane-1,2-diol Formula: C26H46ClNO2 MolecularWeight: 440.10194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN(CC1=CC=C(C=C1)Cl)CC(CO)O

Isomeric SMILES

CCCCCCCCCCCCCCCCN(CC1=CC=C(C=C1)Cl)CC(CO)O

InChI

InChI=1S/C26H46ClNO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-28(22-26(30)23-29)21-24-16-18-25(27)19-17-24/h16-19,26,29-30H,2-15,20-23H2,1H3