[2-bromanyl-3-(4-chlorophenyl)carbonyloxy-2-nitro-propyl] 4-chloranylbenzoate

Systemtic Name: [2-bromanyl-3-(4-chlorophenyl)carbonyloxy-2-nitro-propyl] 4-chloranylbenzoate Openeye Name: [2-bromo-3-(4-chlorobenzoyl)oxy-2-nitro-propyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [2-bromo-3-[(4-chlorophenyl)-oxomethoxy]-2-nitropropyl] ester IUPAC Name: [2-bromo-3-(4-chlorobenzoyl)oxy-2-nitropropyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [2-bromo-3-(4-chlorobenzoyl)oxy-2-nitro-propyl] ester Formula: C17H12BrCl2NO6 MolecularWeight: 477.09028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC(COC(=O)C2=CC=C(C=C2)Cl)([N+](=O)[O-])Br)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC(COC(=O)C2=CC=C(C=C2)Cl)([N+](=O)[O-])Br)Cl

InChI

InChI=1S/C17H12BrCl2NO6/c18-17(21(24)25,9-26-15(22)11-1-5-13(19)6-2-11)10-27-16(23)12-3-7-14(20)8-4-12/h1-8H,9-10H2