[(1S)-1-[4-(4-chloranyl-2-nitro-phenoxy)-3-fluoranyl-phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[4-(4-chloranyl-2-nitro-phenoxy)-3-fluoranyl-phenyl]ethyl]azanium Openeye Name: [(1S)-1-[4-(4-chloro-2-nitro-phenoxy)-3-fluoro-phenyl]ethyl]ammonium CAS Name: [(1S)-1-[4-(4-chloro-2-nitrophenoxy)-3-fluorophenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[4-(4-chloro-2-nitrophenoxy)-3-fluorophenyl]ethyl]azanium Traditional Name: [(1S)-1-[4-(4-chloro-2-nitro-phenoxy)-3-fluoro-phenyl]ethyl]ammonium Formula: C14H13ClFN2O3+ MolecularWeight: 311.716023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-])F)[NH3+]

Isomeric SMILES

C[C@@H](C1=CC(=C(C=C1)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-])F)[NH3+]

InChI

InChI=1S/C14H12ClFN2O3/c1-8(17)9-2-4-13(11(16)6-9)21-14-5-3-10(15)7-12(14)18(19)20/h2-8H,17H2,1H3/p+1/t8-/m0/s1