3-(4-chloranyl-3-nitro-phenyl)-2-methyl-3-oxidanylidene-propanoic acid

Systemtic Name: 3-(4-chloranyl-3-nitro-phenyl)-2-methyl-3-oxidanylidene-propanoic acid Openeye Name: 3-(4-chloro-3-nitro-phenyl)-2-methyl-3-oxo-propanoic acid CAS Name: 3-(4-chloro-3-nitrophenyl)-2-methyl-3-oxopropanoic acid IUPAC Name: 3-(4-chloro-3-nitrophenyl)-2-methyl-3-oxopropanoic acid Traditional Name: 3-(4-chloro-3-nitro-phenyl)-3-keto-2-methyl-propionic acid Formula: C10H8ClNO5 MolecularWeight: 257.62722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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