1-(3,5-dimethylphenoxy)-3-[4-(4-methoxyphenyl)piperazin-1-yl]propan-2-ol hydrochloride

Systemtic Name: 1-(3,5-dimethylphenoxy)-3-[4-(4-methoxyphenyl)piperazin-1-yl]propan-2-ol hydrochloride Openeye Name: 1-(3,5-dimethylphenoxy)-3-[4-(4-methoxyphenyl)piperazin-1-yl]propan-2-ol hydrochloride CAS Name: 1-(3,5-dimethylphenoxy)-3-[4-(4-methoxyphenyl)-1-piperazinyl]-2-propanol hydrochloride IUPAC Name: 1-(3,5-dimethylphenoxy)-3-[4-(4-methoxyphenyl)piperazin-1-yl]propan-2-ol hydrochloride Traditional Name: 1-(3,5-dimethylphenoxy)-3-[4-(4-methoxyphenyl)piperazino]propan-2-ol hydrochloride Formula: C22H31ClN2O3 MolecularWeight: 406.94614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N2O3.ClH/c1-17-12-18(2)14-22(13-17)27-16-20(25)15-23-8-10-24(11-9-23)19-4-6-21(26-3)7-5-19;/h4-7,12-14,20,25H,8-11,15-16H2,1-3H3;1H