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

Systemtic Name: [(1R)-1-(3-nitrophenyl)ethyl] 4-bromanyl-3-nitro-benzoate Openeye Name: [(1R)-1-(3-nitrophenyl)ethyl] 4-bromo-3-nitro-benzoate CAS Name: 4-bromo-3-nitrobenzoic acid [(1R)-1-(3-nitrophenyl)ethyl] ester IUPAC Name: [(1R)-1-(3-nitrophenyl)ethyl] 4-bromo-3-nitrobenzoate Traditional Name: 4-bromo-3-nitro-benzoic acid [(1R)-1-(3-nitrophenyl)ethyl] ester Formula: C15H11BrN2O6 MolecularWeight: 395.16164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11BrN2O6/c1-9(10-3-2-4-12(7-10)17(20)21)24-15(19)11-5-6-13(16)14(8-11)18(22)23/h2-9H,1H3/t9-/m1/s1