4-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]oxy-2-methyl-aniline dihydrochloride

Systemtic Name: 4-[4-(4-chlorophenyl)-1-imidazol-1-yl-butan-2-yl]oxy-2-methyl-aniline dihydrochloride Openeye Name: 4-[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propoxy]-2-methyl-aniline dihydrochloride CAS Name: 4-[4-(4-chlorophenyl)-1-(1-imidazolyl)butan-2-yl]oxy-2-methylaniline dihydrochloride IUPAC Name: 4-[4-(4-chlorophenyl)-1-imidazol-1-ylbutan-2-yl]oxy-2-methylaniline dihydrochloride Traditional Name: [4-[3-(4-chlorophenyl)-1-(imidazol-1-ylmethyl)propoxy]-2-methyl-phenyl]amine dihydrochloride Formula: C20H24Cl3N3O MolecularWeight: 428.78306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(CCC2=CC=C(C=C2)Cl)CN3C=CN=C3)N.Cl.Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OC(CCC2=CC=C(C=C2)Cl)CN3C=CN=C3)N.Cl.Cl

InChI

InChI=1S/C20H22ClN3O.2ClH/c1-15-12-18(8-9-20(15)22)25-19(13-24-11-10-23-14-24)7-4-16-2-5-17(21)6-3-16;;/h2-3,5-6,8-12,14,19H,4,7,13,22H2,1H3;2*1H