(2R,4S)-5-chloranyl-2,4-dimethyl-5-oxidanylidene-pentanoic acid

Systemtic Name: (2R,4S)-5-chloranyl-2,4-dimethyl-5-oxidanylidene-pentanoic acid Openeye Name: (2R,4S)-5-chloro-2,4-dimethyl-5-oxo-pentanoic acid CAS Name: (2R,4S)-5-chloro-2,4-dimethyl-5-oxopentanoic acid IUPAC Name: (2R,4S)-5-chloro-2,4-dimethyl-5-oxopentanoic acid Traditional Name: (2R,4S)-5-chloro-5-keto-2,4-dimethyl-valeric acid Formula: C7H11ClO3 MolecularWeight: 178.61344

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)C(=O)Cl)C(=O)O

Isomeric SMILES

C[C@H](C[C@H](C)C(=O)Cl)C(=O)O

InChI

InChI=1S/C7H11ClO3/c1-4(6(8)9)3-5(2)7(10)11/h4-5H,3H2,1-2H3,(H,10,11)/t4-,5+/m0/s1