ethyl 4-[3,6-bis(fluoranyl)-2-(methoxymethyl)-4-nitro-phenyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3,6-bis(fluoranyl)-2-(methoxymethyl)-4-nitro-phenyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3,6-difluoro-2-(methoxymethyl)-4-nitro-phenyl]piperazine-1-carboxylate CAS Name: 4-[3,6-difluoro-2-(methoxymethyl)-4-nitrophenyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3,6-difluoro-2-(methoxymethyl)-4-nitrophenyl]piperazine-1-carboxylate Traditional Name: 4-[3,6-difluoro-2-(methoxymethyl)-4-nitro-phenyl]piperazine-1-carboxylic acid ethyl ester Formula: C15H19F2N3O5 MolecularWeight: 359.325266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C=C(C(=C2COC)F)[N+](=O)[O-])F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C=C(C(=C2COC)F)[N+](=O)[O-])F

InChI

InChI=1S/C15H19F2N3O5/c1-3-25-15(21)19-6-4-18(5-7-19)14-10(9-24-2)13(17)12(20(22)23)8-11(14)16/h8H,3-7,9H2,1-2H3