(phenylmethyl) 4-(4-ethanoyl-2-fluoranyl-phenyl)piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-(4-ethanoyl-2-fluoranyl-phenyl)piperazine-1-carboxylate Openeye Name: benzyl 4-(4-acetyl-2-fluoro-phenyl)piperazine-1-carboxylate CAS Name: 4-(4-acetyl-2-fluorophenyl)-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(4-acetyl-2-fluorophenyl)piperazine-1-carboxylate Traditional Name: 4-(4-acetyl-2-fluoro-phenyl)piperazine-1-carboxylic acid benzyl ester Formula: C20H21FN2O3 MolecularWeight: 356.390743

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)OCC3=CC=CC=C3)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)OCC3=CC=CC=C3)F

InChI

InChI=1S/C20H21FN2O3/c1-15(24)17-7-8-19(18(21)13-17)22-9-11-23(12-10-22)20(25)26-14-16-5-3-2-4-6-16/h2-8,13H,9-12,14H2,1H3