4-(5-chloranyl-2-methoxy-3-nitro-phenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(5-chloranyl-2-methoxy-3-nitro-phenyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(5-chloro-2-methoxy-3-nitro-phenyl)-4-oxo-butanoic acid CAS Name: 4-(5-chloro-2-methoxy-3-nitrophenyl)-4-oxobutanoic acid IUPAC Name: 4-(5-chloro-2-methoxy-3-nitrophenyl)-4-oxobutanoic acid Traditional Name: 4-(5-chloro-2-methoxy-3-nitro-phenyl)-4-keto-butyric acid Formula: C11H10ClNO6 MolecularWeight: 287.6532

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C(=O)CCC(=O)O)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1C(=O)CCC(=O)O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C11H10ClNO6/c1-19-11-7(9(14)2-3-10(15)16)4-6(12)5-8(11)13(17)18/h4-5H,2-3H2,1H3,(H,15,16)