ethyl 4-[4-fluoranyl-2-nitro-5-[[(2R)-oxolan-2-yl]methylamino]phenyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-fluoranyl-2-nitro-5-[[(2R)-oxolan-2-yl]methylamino]phenyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[4-fluoro-2-nitro-5-[[(2R)-tetrahydrofuran-2-yl]methylamino]phenyl]piperazine-1-carboxylate CAS Name: 4-[4-fluoro-2-nitro-5-[[(2R)-2-oxolanyl]methylamino]phenyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-fluoro-2-nitro-5-[[(2R)-oxolan-2-yl]methylamino]phenyl]piperazine-1-carboxylate Traditional Name: 4-[4-fluoro-2-nitro-5-[[(2R)-tetrahydrofuran-2-yl]methylamino]phenyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H25FN4O5 MolecularWeight: 396.413303

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=CC(=C(C=C2[N+](=O)[O-])F)NCC3CCCO3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=CC(=C(C=C2[N+](=O)[O-])F)NC[C@H]3CCCO3

InChI

InChI=1S/C18H25FN4O5/c1-2-27-18(24)22-7-5-21(6-8-22)16-11-15(14(19)10-17(16)23(25)26)20-12-13-4-3-9-28-13/h10-11,13,20H,2-9,12H2,1H3/t13-/m1/s1