[6-(hydroxymethyl)-5-[(7-phenethyloxyheptan-2-ylamino)methyl]pyridin-2-yl]methanol dihydrochloride

Systemtic Name: [6-(hydroxymethyl)-5-[(7-phenethyloxyheptan-2-ylamino)methyl]pyridin-2-yl]methanol dihydrochloride Openeye Name: [6-(hydroxymethyl)-5-[[(1-methyl-6-phenethyloxy-hexyl)amino]methyl]-2-pyridyl]methanol dihydrochloride CAS Name: [6-(hydroxymethyl)-5-[(7-phenethyloxyheptan-2-ylamino)methyl]-2-pyridinyl]methanol dihydrochloride IUPAC Name: [6-(hydroxymethyl)-5-[(7-phenethyloxyheptan-2-ylamino)methyl]pyridin-2-yl]methanol dihydrochloride Traditional Name: [6-methylol-5-[[(1-methyl-6-phenethyloxy-hexyl)amino]methyl]-2-pyridyl]methanol dihydrochloride Formula: C23H36Cl2N2O3 MolecularWeight: 459.44954

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCOCCC1=CC=CC=C1)NCC2=C(N=C(C=C2)CO)CO.Cl.Cl

Isomeric SMILES

CC(CCCCCOCCC1=CC=CC=C1)NCC2=C(N=C(C=C2)CO)CO.Cl.Cl

InChI

InChI=1S/C23H34N2O3.2ClH/c1-19(24-16-21-11-12-22(17-26)25-23(21)18-27)8-4-3-7-14-28-15-13-20-9-5-2-6-10-20;;/h2,5-6,9-12,19,24,26-27H,3-4,7-8,13-18H2,1H3;2*1H