6-(dibutylamino)-1-phenanthren-9-yl-hexan-1-ol chloride

Systemtic Name: 6-(dibutylamino)-1-phenanthren-9-yl-hexan-1-ol chloride Openeye Name: 6-(dibutylamino)-1-(9-phenanthryl)hexan-1-ol chloride CAS Name: 6-(dibutylamino)-1-(9-phenanthrenyl)-1-hexanol chloride IUPAC Name: 6-(dibutylamino)-1-phenanthren-9-ylhexan-1-ol chloride Traditional Name: 6-(dibutylamino)-1-(9-phenanthryl)hexan-1-ol chloride Formula: C28H39ClNO- MolecularWeight: 441.06836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCCCC(C1=CC2=CC=CC=C2C3=CC=CC=C31)O.[Cl-]

Isomeric SMILES

CCCCN(CCCC)CCCCCC(C1=CC2=CC=CC=C2C3=CC=CC=C31)O.[Cl-]

InChI

InChI=1S/C28H39NO.ClH/c1-3-5-19-29(20-6-4-2)21-13-7-8-18-28(30)27-22-23-14-9-10-15-24(23)25-16-11-12-17-26(25)27;/h9-12,14-17,22,28,30H,3-8,13,18-21H2,1-2H3;1H/p-1