[(1R)-1-(4-fluorophenyl)ethyl] 3-methyl-4-nitro-benzoate

Systemtic Name: [(1R)-1-(4-fluorophenyl)ethyl] 3-methyl-4-nitro-benzoate Openeye Name: [(1R)-1-(4-fluorophenyl)ethyl] 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid [(1R)-1-(4-fluorophenyl)ethyl] ester IUPAC Name: [(1R)-1-(4-fluorophenyl)ethyl] 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [(1R)-1-(4-fluorophenyl)ethyl] ester Formula: C16H14FNO4 MolecularWeight: 303.285063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC(C)C2=CC=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O[C@H](C)C2=CC=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C16H14FNO4/c1-10-9-13(5-8-15(10)18(20)21)16(19)22-11(2)12-3-6-14(17)7-4-12/h3-9,11H,1-2H3/t11-/m1/s1