methyl 2-[acetyloxy-(5-bromanyl-2-nitro-phenyl)methyl]prop-2-enoate

Systemtic Name: methyl 2-[acetyloxy-(5-bromanyl-2-nitro-phenyl)methyl]prop-2-enoate Openeye Name: methyl 2-[acetoxy-(5-bromo-2-nitro-phenyl)methyl]prop-2-enoate CAS Name: 2-[acetyloxy-(5-bromo-2-nitrophenyl)methyl]-2-propenoic acid methyl ester IUPAC Name: methyl 2-[acetyloxy-(5-bromo-2-nitrophenyl)methyl]prop-2-enoate Traditional Name: 2-[acetoxy-(5-bromo-2-nitro-phenyl)methyl]acrylic acid methyl ester Formula: C13H12BrNO6 MolecularWeight: 358.14148

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12BrNO6/c1-7(13(17)20-3)12(21-8(2)16)10-6-9(14)4-5-11(10)15(18)19/h4-6,12H,1H2,2-3H3