4-[3-[4-(2,5-dimethoxyphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]-3-methyl-phenol dihydrochloride

Systemtic Name: 4-[3-[4-(2,5-dimethoxyphenyl)piperazin-1-yl]-2-oxidanyl-propoxy]-3-methyl-phenol dihydrochloride Openeye Name: 4-[3-[4-(2,5-dimethoxyphenyl)piperazin-1-yl]-2-hydroxy-propoxy]-3-methyl-phenol dihydrochloride CAS Name: 4-[3-[4-(2,5-dimethoxyphenyl)-1-piperazinyl]-2-hydroxypropoxy]-3-methylphenol dihydrochloride IUPAC Name: 4-[3-[4-(2,5-dimethoxyphenyl)piperazin-1-yl]-2-hydroxypropoxy]-3-methylphenol dihydrochloride Traditional Name: 4-[3-[4-(2,5-dimethoxyphenyl)piperazino]-2-hydroxy-propoxy]-3-methyl-phenol dihydrochloride Formula: C22H32Cl2N2O5 MolecularWeight: 475.40588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)O)OCC(CN2CCN(CC2)C3=C(C=CC(=C3)OC)OC)O.Cl.Cl

Isomeric SMILES

CC1=C(C=CC(=C1)O)OCC(CN2CCN(CC2)C3=C(C=CC(=C3)OC)OC)O.Cl.Cl

InChI

InChI=1S/C22H30N2O5.2ClH/c1-16-12-17(25)4-6-21(16)29-15-18(26)14-23-8-10-24(11-9-23)20-13-19(27-2)5-7-22(20)28-3;;/h4-7,12-13,18,25-26H,8-11,14-15H2,1-3H3;2*1H