2-(6-bromanyl-5-chloranyl-2-nitro-cyclohexa-2,4-dien-1-yl)-2-methyl-propanoic acid

Systemtic Name: 2-(6-bromanyl-5-chloranyl-2-nitro-cyclohexa-2,4-dien-1-yl)-2-methyl-propanoic acid Openeye Name: 2-(6-bromo-5-chloro-2-nitro-cyclohexa-2,4-dien-1-yl)-2-methyl-propanoic acid CAS Name: 2-(6-bromo-5-chloro-2-nitro-1-cyclohexa-2,4-dienyl)-2-methylpropanoic acid IUPAC Name: 2-(6-bromo-5-chloro-2-nitrocyclohexa-2,4-dien-1-yl)-2-methylpropanoic acid Traditional Name: 2-(6-bromo-5-chloro-2-nitro-cyclohexa-2,4-dien-1-yl)-2-methyl-propionic acid Formula: C10H11BrClNO4 MolecularWeight: 324.55564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11BrClNO4/c1-10(2,9(14)15)7-6(13(16)17)4-3-5(12)8(7)11/h3-4,7-8H,1-2H3,(H,14,15)