ethanedioic acid; 1-(2-fluoranylphenoxy)-3-[4-(4-methoxyphenyl)piperazin-1-yl]propan-2-ol

Systemtic Name: ethanedioic acid; 1-(2-fluoranylphenoxy)-3-[4-(4-methoxyphenyl)piperazin-1-yl]propan-2-ol Openeye Name: 1-(2-fluorophenoxy)-3-[4-(4-methoxyphenyl)piperazin-1-yl]propan-2-ol; oxalic acid CAS Name: 1-(2-fluorophenoxy)-3-[4-(4-methoxyphenyl)-1-piperazinyl]-2-propanol; oxalic acid IUPAC Name: 1-(2-fluorophenoxy)-3-[4-(4-methoxyphenyl)piperazin-1-yl]propan-2-ol; oxalic acid Traditional Name: 1-(2-fluorophenoxy)-3-[4-(4-methoxyphenyl)piperazino]propan-2-ol; oxalic acid Formula: C22H27FN2O7 MolecularWeight: 450.457383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CC(COC3=CC=CC=C3F)O.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CC(COC3=CC=CC=C3F)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H25FN2O3.C2H2O4/c1-25-18-8-6-16(7-9-18)23-12-10-22(11-13-23)14-17(24)15-26-20-5-3-2-4-19(20)21;3-1(4)2(5)6/h2-9,17,24H,10-15H2,1H3;(H,3,4)(H,5,6)