[(1R)-1-phenylethyl] 4-bromanyl-3-nitro-benzoate

Systemtic Name: [(1R)-1-phenylethyl] 4-bromanyl-3-nitro-benzoate Openeye Name: [(1R)-1-phenylethyl] 4-bromo-3-nitro-benzoate CAS Name: 4-bromo-3-nitrobenzoic acid [(1R)-1-phenylethyl] ester IUPAC Name: [(1R)-1-phenylethyl] 4-bromo-3-nitrobenzoate Traditional Name: 4-bromo-3-nitro-benzoic acid [(1R)-1-phenylethyl] ester Formula: C15H12BrNO4 MolecularWeight: 350.16408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12BrNO4/c1-10(11-5-3-2-4-6-11)21-15(18)12-7-8-13(16)14(9-12)17(19)20/h2-10H,1H3/t10-/m1/s1