(2-fluoranyl-5-prop-2-enoxy-phenyl)methyl (2R,6S)-2,6-dimethylpiperazine-1-carboxylate

Systemtic Name: (2-fluoranyl-5-prop-2-enoxy-phenyl)methyl (2R,6S)-2,6-dimethylpiperazine-1-carboxylate Openeye Name: (5-allyloxy-2-fluoro-phenyl)methyl (2R,6S)-2,6-dimethylpiperazine-1-carboxylate CAS Name: (2R,6S)-2,6-dimethyl-1-piperazinecarboxylic acid (2-fluoro-5-prop-2-enoxyphenyl)methyl ester IUPAC Name: (2-fluoro-5-prop-2-enoxyphenyl)methyl (2R,6S)-2,6-dimethylpiperazine-1-carboxylate Traditional Name: (2R,6S)-2,6-dimethylpiperazine-1-carboxylic acid (5-allyloxy-2-fluoro-benzyl) ester Formula: C17H23FN2O3 MolecularWeight: 322.374523

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCC(N1C(=O)OCC2=C(C=CC(=C2)OCC=C)F)C

Isomeric SMILES

C[C@@H]1CNC[C@@H](N1C(=O)OCC2=C(C=CC(=C2)OCC=C)F)C

InChI

InChI=1S/C17H23FN2O3/c1-4-7-22-15-5-6-16(18)14(8-15)11-23-17(21)20-12(2)9-19-10-13(20)3/h4-6,8,12-13,19H,1,7,9-11H2,2-3H3/t12-,13+