ethyl 4-[[5-(4-fluorophenyl)-2-oxidanyl-phenyl]methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[5-(4-fluorophenyl)-2-oxidanyl-phenyl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[5-(4-fluorophenyl)-2-hydroxy-phenyl]methyl]piperazine-1-carboxylate CAS Name: 4-[[5-(4-fluorophenyl)-2-hydroxyphenyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[5-(4-fluorophenyl)-2-hydroxyphenyl]methyl]piperazine-1-carboxylate Traditional Name: 4-[5-(4-fluorophenyl)-2-hydroxy-benzyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H23FN2O3 MolecularWeight: 358.406623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC2=C(C=CC(=C2)C3=CC=C(C=C3)F)O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC2=C(C=CC(=C2)C3=CC=C(C=C3)F)O

InChI

InChI=1S/C20H23FN2O3/c1-2-26-20(25)23-11-9-22(10-12-23)14-17-13-16(5-8-19(17)24)15-3-6-18(21)7-4-15/h3-8,13,24H,2,9-12,14H2,1H3