ethanedioic acid; 1-(4-fluorophenyl)-4-[2-(2-propan-2-yloxyphenoxy)ethylamino]butan-1-ol

Systemtic Name: ethanedioic acid; 1-(4-fluorophenyl)-4-[2-(2-propan-2-yloxyphenoxy)ethylamino]butan-1-ol Openeye Name: 1-(4-fluorophenyl)-4-[2-(2-isopropoxyphenoxy)ethylamino]butan-1-ol; oxalic acid CAS Name: 1-(4-fluorophenyl)-4-[2-(2-propan-2-yloxyphenoxy)ethylamino]-1-butanol; oxalic acid IUPAC Name: 1-(4-fluorophenyl)-4-[2-(2-propan-2-yloxyphenoxy)ethylamino]butan-1-ol; oxalic acid Traditional Name: 1-(4-fluorophenyl)-4-[2-(2-isopropoxyphenoxy)ethylamino]butan-1-ol; oxalic acid Formula: C23H30FNO7 MolecularWeight: 451.485203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1OCCNCCCC(C2=CC=C(C=C2)F)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)OC1=CC=CC=C1OCCNCCCC(C2=CC=C(C=C2)F)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H28FNO3.C2H2O4/c1-16(2)26-21-8-4-3-7-20(21)25-15-14-23-13-5-6-19(24)17-9-11-18(22)12-10-17;3-1(4)2(5)6/h3-4,7-12,16,19,23-24H,5-6,13-15H2,1-2H3;(H,3,4)(H,5,6)