2-(diheptylamino)-1-phenanthren-3-yl-ethanol hydrochloride

Systemtic Name: 2-(diheptylamino)-1-phenanthren-3-yl-ethanol hydrochloride Openeye Name: 2-(diheptylamino)-1-(3-phenanthryl)ethanol hydrochloride CAS Name: 2-(diheptylamino)-1-(3-phenanthrenyl)ethanol hydrochloride IUPAC Name: 2-(diheptylamino)-1-phenanthren-3-ylethanol hydrochloride Traditional Name: 2-(diheptylamino)-1-(3-phenanthryl)ethanol hydrochloride Formula: C30H44ClNO MolecularWeight: 470.12946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCCCCCC)CC(C1=CC2=C(C=CC3=CC=CC=C32)C=C1)O.Cl

Isomeric SMILES

CCCCCCCN(CCCCCCC)CC(C1=CC2=C(C=CC3=CC=CC=C32)C=C1)O.Cl

InChI

InChI=1S/C30H43NO.ClH/c1-3-5-7-9-13-21-31(22-14-10-8-6-4-2)24-30(32)27-20-19-26-18-17-25-15-11-12-16-28(25)29(26)23-27;/h11-12,15-20,23,30,32H,3-10,13-14,21-22,24H2,1-2H3;1H