1-(4-chloranylphenoxy)-3-[4-(3,4-dimethoxyphenyl)piperazin-1-yl]propan-2-ol

Systemtic Name: 1-(4-chloranylphenoxy)-3-[4-(3,4-dimethoxyphenyl)piperazin-1-yl]propan-2-ol Openeye Name: 1-(4-chlorophenoxy)-3-[4-(3,4-dimethoxyphenyl)piperazin-1-yl]propan-2-ol CAS Name: 1-(4-chlorophenoxy)-3-[4-(3,4-dimethoxyphenyl)-1-piperazinyl]-2-propanol IUPAC Name: 1-(4-chlorophenoxy)-3-[4-(3,4-dimethoxyphenyl)piperazin-1-yl]propan-2-ol Traditional Name: 1-(4-chlorophenoxy)-3-[4-(3,4-dimethoxyphenyl)piperazino]propan-2-ol Formula: C21H27ClN2O4 MolecularWeight: 406.90308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2CCN(CC2)CC(COC3=CC=C(C=C3)Cl)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2CCN(CC2)CC(COC3=CC=C(C=C3)Cl)O)OC

InChI

InChI=1S/C21H27ClN2O4/c1-26-20-8-5-17(13-21(20)27-2)24-11-9-23(10-12-24)14-18(25)15-28-19-6-3-16(22)4-7-19/h3-8,13,18,25H,9-12,14-15H2,1-2H3