methyl 3-(2-bromanyl-6-nitro-phenyl)-2-oxidanylidene-but-3-enoate

Systemtic Name: methyl 3-(2-bromanyl-6-nitro-phenyl)-2-oxidanylidene-but-3-enoate Openeye Name: methyl 3-(2-bromo-6-nitro-phenyl)-2-oxo-but-3-enoate CAS Name: 3-(2-bromo-6-nitrophenyl)-2-oxo-3-butenoic acid methyl ester IUPAC Name: methyl 3-(2-bromo-6-nitrophenyl)-2-oxobut-3-enoate Traditional Name: 3-(2-bromo-6-nitro-phenyl)-2-keto-but-3-enoic acid methyl ester Formula: C11H8BrNO5 MolecularWeight: 314.08892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H8BrNO5/c1-6(10(14)11(15)18-2)9-7(12)4-3-5-8(9)13(16)17/h3-5H,1H2,2H3