1-[6,7-bis(chloranyl)phenanthren-1-yl]-2-(dibutylamino)ethanol

Systemtic Name: 1-[6,7-bis(chloranyl)phenanthren-1-yl]-2-(dibutylamino)ethanol Openeye Name: 2-(dibutylamino)-1-(6,7-dichloro-1-phenanthryl)ethanol CAS Name: 2-(dibutylamino)-1-(6,7-dichloro-1-phenanthrenyl)ethanol IUPAC Name: 2-(dibutylamino)-1-(6,7-dichlorophenanthren-1-yl)ethanol Traditional Name: 2-(dibutylamino)-1-(6,7-dichloro-1-phenanthryl)ethanol Formula: C24H29Cl2NO MolecularWeight: 418.39916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CC(C1=CC=CC2=C1C=CC3=CC(=C(C=C32)Cl)Cl)O

Isomeric SMILES

CCCCN(CCCC)CC(C1=CC=CC2=C1C=CC3=CC(=C(C=C32)Cl)Cl)O

InChI

InChI=1S/C24H29Cl2NO/c1-3-5-12-27(13-6-4-2)16-24(28)20-9-7-8-18-19(20)11-10-17-14-22(25)23(26)15-21(17)18/h7-11,14-15,24,28H,3-6,12-13,16H2,1-2H3