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

Systemtic Name: 3-(2-chloranyl-3-methyl-6-nitro-phenyl)-2-oxidanylidene-propanoic acid Openeye Name: 3-(2-chloro-3-methyl-6-nitro-phenyl)-2-oxo-propanoic acid CAS Name: 3-(2-chloro-3-methyl-6-nitrophenyl)-2-oxopropanoic acid IUPAC Name: 3-(2-chloro-3-methyl-6-nitrophenyl)-2-oxopropanoic acid Traditional Name: 3-(2-chloro-3-methyl-6-nitro-phenyl)-2-keto-propionic acid Formula: C10H8ClNO5 MolecularWeight: 257.62722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])CC(=O)C(=O)O)Cl

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])CC(=O)C(=O)O)Cl

InChI

InChI=1S/C10H8ClNO5/c1-5-2-3-7(12(16)17)6(9(5)11)4-8(13)10(14)15/h2-3H,4H2,1H3,(H,14,15)