ethyl 4-[3-(2-fluoranyl-5-methyl-phenyl)prop-2-ynyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(2-fluoranyl-5-methyl-phenyl)prop-2-ynyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(2-fluoro-5-methyl-phenyl)prop-2-ynyl]piperazine-1-carboxylate CAS Name: 4-[3-(2-fluoro-5-methylphenyl)prop-2-ynyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(2-fluoro-5-methylphenyl)prop-2-ynyl]piperazine-1-carboxylate Traditional Name: 4-[3-(2-fluoro-5-methyl-phenyl)prop-2-ynyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H21FN2O2 MolecularWeight: 304.359243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21FN2O2/c1-3-22-17(21)20-11-9-19(10-12-20)8-4-5-15-13-14(2)6-7-16(15)18/h6-7,13H,3,8-12H2,1-2H3