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

Systemtic Name: ethyl 4-[3,6-bis(fluoranyl)-2-methyl-4-nitro-phenyl]piperazine-1-carboxylate Openeye Name: ethyl 4-(3,6-difluoro-2-methyl-4-nitro-phenyl)piperazine-1-carboxylate CAS Name: 4-(3,6-difluoro-2-methyl-4-nitrophenyl)-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,6-difluoro-2-methyl-4-nitrophenyl)piperazine-1-carboxylate Traditional Name: 4-(3,6-difluoro-2-methyl-4-nitro-phenyl)piperazine-1-carboxylic acid ethyl ester Formula: C14H17F2N3O4 MolecularWeight: 329.299286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C=C(C(=C2C)F)[N+](=O)[O-])F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C=C(C(=C2C)F)[N+](=O)[O-])F

InChI

InChI=1S/C14H17F2N3O4/c1-3-23-14(20)18-6-4-17(5-7-18)13-9(2)12(16)11(19(21)22)8-10(13)15/h8H,3-7H2,1-2H3