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

Systemtic Name: ethyl 4-[3-[2,3-bis(fluoranyl)-5-methyl-phenyl]prop-2-ynyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(2,3-difluoro-5-methyl-phenyl)prop-2-ynyl]piperazine-1-carboxylate CAS Name: 4-[3-(2,3-difluoro-5-methylphenyl)prop-2-ynyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(2,3-difluoro-5-methylphenyl)prop-2-ynyl]piperazine-1-carboxylate Traditional Name: 4-[3-(2,3-difluoro-5-methyl-phenyl)prop-2-ynyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H20F2N2O2 MolecularWeight: 322.349706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC#CC2=CC(=CC(=C2F)F)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC#CC2=CC(=CC(=C2F)F)C

InChI

InChI=1S/C17H20F2N2O2/c1-3-23-17(22)21-9-7-20(8-10-21)6-4-5-14-11-13(2)12-15(18)16(14)19/h11-12H,3,6-10H2,1-2H3