[(1S)-1-(2-bromophenyl)ethyl] 4-nitrobenzoate

Systemtic Name: [(1S)-1-(2-bromophenyl)ethyl] 4-nitrobenzoate Openeye Name: [(1S)-1-(2-bromophenyl)ethyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(1S)-1-(2-bromophenyl)ethyl] ester IUPAC Name: [(1S)-1-(2-bromophenyl)ethyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(1S)-1-(2-bromophenyl)ethyl] ester Formula: C15H12BrNO4 MolecularWeight: 350.16408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Br)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1Br)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H12BrNO4/c1-10(13-4-2-3-5-14(13)16)21-15(18)11-6-8-12(9-7-11)17(19)20/h2-10H,1H3/t10-/m0/s1