5-(4-chloranyl-3-methyl-phenyl)-5-oxidanylidene-pentanoate

Systemtic Name: 5-(4-chloranyl-3-methyl-phenyl)-5-oxidanylidene-pentanoate Openeye Name: 5-(4-chloro-3-methyl-phenyl)-5-oxo-pentanoate CAS Name: 5-(4-chloro-3-methylphenyl)-5-oxopentanoate IUPAC Name: 5-(4-chloro-3-methylphenyl)-5-oxopentanoate Traditional Name: 5-(4-chloro-3-methyl-phenyl)-5-keto-valerate Formula: C12H12ClO3- MolecularWeight: 239.67488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13ClO3/c1-8-7-9(5-6-10(8)13)11(14)3-2-4-12(15)16/h5-7H,2-4H2,1H3,(H,15,16)/p-1