ethanedioic acid; 2-[[4-[(4-fluorophenyl)methyl]piperazin-1-yl]methyl]-4-methoxy-phenol

Systemtic Name: ethanedioic acid; 2-[[4-[(4-fluorophenyl)methyl]piperazin-1-yl]methyl]-4-methoxy-phenol Openeye Name: 2-[[4-[(4-fluorophenyl)methyl]piperazin-1-yl]methyl]-4-methoxy-phenol; oxalic acid CAS Name: 2-[[4-[(4-fluorophenyl)methyl]-1-piperazinyl]methyl]-4-methoxyphenol; oxalic acid IUPAC Name: 2-[[4-[(4-fluorophenyl)methyl]piperazin-1-yl]methyl]-4-methoxyphenol; oxalic acid Traditional Name: 2-[[4-(4-fluorobenzyl)piperazino]methyl]-4-methoxy-phenol; oxalic acid Formula: C21H25FN2O6 MolecularWeight: 420.431403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)CN2CCN(CC2)CC3=CC=C(C=C3)F.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC(=C(C=C1)O)CN2CCN(CC2)CC3=CC=C(C=C3)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H23FN2O2.C2H2O4/c1-24-18-6-7-19(23)16(12-18)14-22-10-8-21(9-11-22)13-15-2-4-17(20)5-3-15;3-1(4)2(5)6/h2-7,12,23H,8-11,13-14H2,1H3;(H,3,4)(H,5,6)