ethanedioic acid; 6-[2-[3-(2-fluorophenyl)propyl-(2-hydroxyethyl)amino]ethylamino]-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: ethanedioic acid; 6-[2-[3-(2-fluorophenyl)propyl-(2-hydroxyethyl)amino]ethylamino]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 6-[2-[3-(2-fluorophenyl)propyl-(2-hydroxyethyl)amino]ethylamino]-1,3-dimethyl-pyrimidine-2,4-dione; oxalic acid CAS Name: 6-[2-[3-(2-fluorophenyl)propyl-(2-hydroxyethyl)amino]ethylamino]-1,3-dimethylpyrimidine-2,4-dione; oxalic acid IUPAC Name: 6-[2-[3-(2-fluorophenyl)propyl-(2-hydroxyethyl)amino]ethylamino]-1,3-dimethylpyrimidine-2,4-dione; oxalic acid Traditional Name: 6-[2-[3-(2-fluorophenyl)propyl-(2-hydroxyethyl)amino]ethylamino]-1,3-dimethyl-pyrimidine-2,4-quinone; oxalic acid Formula: C21H29FN4O7 MolecularWeight: 468.475963

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)NCCN(CCCC2=CC=CC=C2F)CCO.C(=O)(C(=O)O)O

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)NCCN(CCCC2=CC=CC=C2F)CCO.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H27FN4O3.C2H2O4/c1-22-17(14-18(26)23(2)19(22)27)21-9-11-24(12-13-25)10-5-7-15-6-3-4-8-16(15)20;3-1(4)2(5)6/h3-4,6,8,14,21,25H,5,7,9-13H2,1-2H3;(H,3,4)(H,5,6)