4-(3-chloranyl-2-methoxy-phenyl)-2-oxidanylidene-pentanoic acid

Systemtic Name: 4-(3-chloranyl-2-methoxy-phenyl)-2-oxidanylidene-pentanoic acid Openeye Name: 4-(3-chloro-2-methoxy-phenyl)-2-oxo-pentanoic acid CAS Name: 4-(3-chloro-2-methoxyphenyl)-2-oxopentanoic acid IUPAC Name: 4-(3-chloro-2-methoxyphenyl)-2-oxopentanoic acid Traditional Name: 4-(3-chloro-2-methoxy-phenyl)-2-keto-valeric acid Formula: C12H13ClO4 MolecularWeight: 256.68222

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C(=O)O)C1=C(C(=CC=C1)Cl)OC

Isomeric SMILES

CC(CC(=O)C(=O)O)C1=C(C(=CC=C1)Cl)OC

InChI

InChI=1S/C12H13ClO4/c1-7(6-10(14)12(15)16)8-4-3-5-9(13)11(8)17-2/h3-5,7H,6H2,1-2H3,(H,15,16)