3-azanyl-3-(4-imidazol-1-ylphenyl)-1-(2-methylphenoxy)butan-2-ol dihydrochloride

Systemtic Name: 3-azanyl-3-(4-imidazol-1-ylphenyl)-1-(2-methylphenoxy)butan-2-ol dihydrochloride Openeye Name: 3-amino-3-(4-imidazol-1-ylphenyl)-1-(2-methylphenoxy)butan-2-ol dihydrochloride CAS Name: 3-amino-3-[4-(1-imidazolyl)phenyl]-1-(2-methylphenoxy)-2-butanol dihydrochloride IUPAC Name: 3-amino-3-(4-imidazol-1-ylphenyl)-1-(2-methylphenoxy)butan-2-ol dihydrochloride Traditional Name: 3-amino-3-(4-imidazol-1-ylphenyl)-1-(2-methylphenoxy)butan-2-ol dihydrochloride Formula: C20H25Cl2N3O2 MolecularWeight: 410.3374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(C(C)(C2=CC=C(C=C2)N3C=CN=C3)N)O.Cl.Cl

Isomeric SMILES

CC1=CC=CC=C1OCC(C(C)(C2=CC=C(C=C2)N3C=CN=C3)N)O.Cl.Cl

InChI

InChI=1S/C20H23N3O2.2ClH/c1-15-5-3-4-6-18(15)25-13-19(24)20(2,21)16-7-9-17(10-8-16)23-12-11-22-14-23;;/h3-12,14,19,24H,13,21H2,1-2H3;2*1H