4-octadecyl-4-(phenylmethyl)morpholin-4-ium chloride

Systemtic Name: 4-octadecyl-4-(phenylmethyl)morpholin-4-ium chloride Openeye Name: 4-benzyl-4-octadecyl-morpholin-4-ium chloride CAS Name: 4-octadecyl-4-(phenylmethyl)morpholin-4-ium chloride IUPAC Name: 4-benzyl-4-octadecylmorpholin-4-ium chloride Traditional Name: 4-benzyl-4-stearyl-morpholin-4-ium chloride Formula: C29H52ClNO MolecularWeight: 466.18228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+]1(CCOCC1)CC2=CC=CC=C2.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+]1(CCOCC1)CC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C29H52NO.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-30(24-26-31-27-25-30)28-29-21-18-17-19-22-29;/h17-19,21-22H,2-16,20,23-28H2,1H3;1H/q+1;/p-1