3-(2-dimethylaminoethyl)-1-[2-(4-fluoranylphenoxy)ethyl]-1-propan-2-yl-urea; ethanedioic acid

Systemtic Name: 3-(2-dimethylaminoethyl)-1-[2-(4-fluoranylphenoxy)ethyl]-1-propan-2-yl-urea; ethanedioic acid Openeye Name: 3-(2-dimethylaminoethyl)-1-[2-(4-fluorophenoxy)ethyl]-1-isopropyl-urea; oxalic acid CAS Name: 3-(2-dimethylaminoethyl)-1-[2-(4-fluorophenoxy)ethyl]-1-propan-2-ylurea; oxalic acid IUPAC Name: 3-(2-dimethylaminoethyl)-1-[2-(4-fluorophenoxy)ethyl]-1-propan-2-ylurea; oxalic acid Traditional Name: 3-(2-dimethylaminoethyl)-1-[2-(4-fluorophenoxy)ethyl]-1-isopropyl-urea; oxalic acid Formula: C18H28FN3O6 MolecularWeight: 401.429823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCOC1=CC=C(C=C1)F)C(=O)NCCN(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)N(CCOC1=CC=C(C=C1)F)C(=O)NCCN(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H26FN3O2.C2H2O4/c1-13(2)20(16(21)18-9-10-19(3)4)11-12-22-15-7-5-14(17)6-8-15;3-1(4)2(5)6/h5-8,13H,9-12H2,1-4H3,(H,18,21);(H,3,4)(H,5,6)