2-azanyl-2-[5-(4-octylphenyl)-1H-imidazol-2-yl]propane-1,3-diol hydrochloride

Systemtic Name: 2-azanyl-2-[5-(4-octylphenyl)-1H-imidazol-2-yl]propane-1,3-diol hydrochloride Openeye Name: 2-amino-2-[5-(4-octylphenyl)-1H-imidazol-2-yl]propane-1,3-diol hydrochloride CAS Name: 2-amino-2-[5-(4-octylphenyl)-1H-imidazol-2-yl]propane-1,3-diol hydrochloride IUPAC Name: 2-amino-2-[5-(4-octylphenyl)-1H-imidazol-2-yl]propane-1,3-diol hydrochloride Traditional Name: 2-amino-2-[5-(4-octylphenyl)-1H-imidazol-2-yl]propane-1,3-diol hydrochloride Formula: C20H32ClN3O2 MolecularWeight: 381.93998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CN=C(N2)C(CO)(CO)N.Cl

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CN=C(N2)C(CO)(CO)N.Cl

InChI

InChI=1S/C20H31N3O2.ClH/c1-2-3-4-5-6-7-8-16-9-11-17(12-10-16)18-13-22-19(23-18)20(21,14-24)15-25;/h9-13,24-25H,2-8,14-15,21H2,1H3,(H,22,23);1H