ethanedioic acid; 2-(4-ethylpiperazin-1-yl)-N-(4-fluorophenyl)ethanamide

Systemtic Name: ethanedioic acid; 2-(4-ethylpiperazin-1-yl)-N-(4-fluorophenyl)ethanamide Openeye Name: 2-(4-ethylpiperazin-1-yl)-N-(4-fluorophenyl)acetamide; oxalic acid CAS Name: 2-(4-ethyl-1-piperazinyl)-N-(4-fluorophenyl)acetamide; oxalic acid IUPAC Name: 2-(4-ethylpiperazin-1-yl)-N-(4-fluorophenyl)acetamide; oxalic acid Traditional Name: 2-(4-ethylpiperazino)-N-(4-fluorophenyl)acetamide; oxalic acid Formula: C18H24FN3O9 MolecularWeight: 445.396263

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC(=O)NC2=CC=C(C=C2)F.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCN(CC1)CC(=O)NC2=CC=C(C=C2)F.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H20FN3O.2C2H2O4/c1-2-17-7-9-18(10-8-17)11-14(19)16-13-5-3-12(15)4-6-13;2*3-1(4)2(5)6/h3-6H,2,7-11H2,1H3,(H,16,19);2*(H,3,4)(H,5,6)