(4-nitrophenyl) N-[[(2S)-4-[1-[3,4-bis(fluoranyl)phenyl]ethyl]morpholin-2-yl]methyl]carbamate

Systemtic Name: (4-nitrophenyl) N-[[(2S)-4-[1-[3,4-bis(fluoranyl)phenyl]ethyl]morpholin-2-yl]methyl]carbamate Openeye Name: (4-nitrophenyl) N-[[(2S)-4-[1-(3,4-difluorophenyl)ethyl]morpholin-2-yl]methyl]carbamate CAS Name: N-[[(2S)-4-[1-(3,4-difluorophenyl)ethyl]-2-morpholinyl]methyl]carbamic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) N-[[(2S)-4-[1-(3,4-difluorophenyl)ethyl]morpholin-2-yl]methyl]carbamate Traditional Name: N-[[(2S)-4-[1-(3,4-difluorophenyl)ethyl]morpholin-2-yl]methyl]carbamic acid (4-nitrophenyl) ester Formula: C20H21F2N3O5 MolecularWeight: 421.394646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)F)F)N2CCOC(C2)CNC(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC(=C(C=C1)F)F)N2CCO[C@H](C2)CNC(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21F2N3O5/c1-13(14-2-7-18(21)19(22)10-14)24-8-9-29-17(12-24)11-23-20(26)30-16-5-3-15(4-6-16)25(27)28/h2-7,10,13,17H,8-9,11-12H2,1H3,(H,23,26)/t13?,17-/m0/s1