[(1S)-1-(3,4-dimethyl-5-nitro-phenyl)-2-(2-fluorophenyl)ethyl]azanium

Systemtic Name: [(1S)-1-(3,4-dimethyl-5-nitro-phenyl)-2-(2-fluorophenyl)ethyl]azanium Openeye Name: [(1S)-1-(3,4-dimethyl-5-nitro-phenyl)-2-(2-fluorophenyl)ethyl]ammonium CAS Name: [(1S)-1-(3,4-dimethyl-5-nitrophenyl)-2-(2-fluorophenyl)ethyl]ammonium IUPAC Name: [(1S)-1-(3,4-dimethyl-5-nitrophenyl)-2-(2-fluorophenyl)ethyl]azanium Traditional Name: [(1S)-1-(3,4-dimethyl-5-nitro-phenyl)-2-(2-fluorophenyl)ethyl]ammonium Formula: C16H18FN2O2+ MolecularWeight: 289.324723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(CC2=CC=CC=C2F)[NH3+])[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC(=C1)[C@H](CC2=CC=CC=C2F)[NH3+])[N+](=O)[O-])C

InChI

InChI=1S/C16H17FN2O2/c1-10-7-13(9-16(11(10)2)19(20)21)15(18)8-12-5-3-4-6-14(12)17/h3-7,9,15H,8,18H2,1-2H3/p+1/t15-/m0/s1