2-(dimethylamino)ethanol; (phenylmethyl) 5-(4-fluorophenyl)-2-oxidanyl-benzoate

Systemtic Name: 2-(dimethylamino)ethanol; (phenylmethyl) 5-(4-fluorophenyl)-2-oxidanyl-benzoate Openeye Name: benzyl 5-(4-fluorophenyl)-2-hydroxy-benzoate; 2-(dimethylamino)ethanol CAS Name: 2-(dimethylamino)ethanol; 5-(4-fluorophenyl)-2-hydroxybenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 5-(4-fluorophenyl)-2-hydroxybenzoate; 2-(dimethylamino)ethanol Traditional Name: 2-(dimethylamino)ethanol; 5-(4-fluorophenyl)-2-hydroxy-benzoic acid benzyl ester Formula: C24H26FNO4 MolecularWeight: 411.465943

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCO.C1=CC=C(C=C1)COC(=O)C2=C(C=CC(=C2)C3=CC=C(C=C3)F)O

Isomeric SMILES

CN(C)CCO.C1=CC=C(C=C1)COC(=O)C2=C(C=CC(=C2)C3=CC=C(C=C3)F)O

InChI

InChI=1S/C20H15FO3.C4H11NO/c21-17-9-6-15(7-10-17)16-8-11-19(22)18(12-16)20(23)24-13-14-4-2-1-3-5-14;1-5(2)3-4-6/h1-12,22H,13H2;6H,3-4H2,1-2H3