3-(3-bromanyl-2-methyl-6-nitro-phenyl)-2-oxidanylidene-propanoic acid

Systemtic Name: 3-(3-bromanyl-2-methyl-6-nitro-phenyl)-2-oxidanylidene-propanoic acid Openeye Name: 3-(3-bromo-2-methyl-6-nitro-phenyl)-2-oxo-propanoic acid CAS Name: 3-(3-bromo-2-methyl-6-nitrophenyl)-2-oxopropanoic acid IUPAC Name: 3-(3-bromo-2-methyl-6-nitrophenyl)-2-oxopropanoic acid Traditional Name: 3-(3-bromo-2-methyl-6-nitro-phenyl)-2-keto-propionic acid Formula: C10H8BrNO5 MolecularWeight: 302.07822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1CC(=O)C(=O)O)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C=CC(=C1CC(=O)C(=O)O)[N+](=O)[O-])Br

InChI

InChI=1S/C10H8BrNO5/c1-5-6(4-9(13)10(14)15)8(12(16)17)3-2-7(5)11/h2-3H,4H2,1H3,(H,14,15)