ethanedioic acid; [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-diphenyl-methanol

Systemtic Name: ethanedioic acid; [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-diphenyl-methanol Openeye Name: [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-diphenyl-methanol; oxalic acid CAS Name: [4-[(2-fluorophenyl)methyl]-1-piperazinyl]-diphenylmethanol; oxalic acid IUPAC Name: [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-diphenylmethanol; oxalic acid Traditional Name: [4-(2-fluorobenzyl)piperazino]-diphenyl-methanol; oxalic acid Formula: C26H27FN2O5 MolecularWeight: 466.501383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2F)C(C3=CC=CC=C3)(C4=CC=CC=C4)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2F)C(C3=CC=CC=C3)(C4=CC=CC=C4)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H25FN2O.C2H2O4/c25-23-14-8-7-9-20(23)19-26-15-17-27(18-16-26)24(28,21-10-3-1-4-11-21)22-12-5-2-6-13-22;3-1(4)2(5)6/h1-14,28H,15-19H2;(H,3,4)(H,5,6)