4-(2-chloranyl-3-methyl-pentanoyl)oxybenzoate

Systemtic Name: 4-(2-chloranyl-3-methyl-pentanoyl)oxybenzoate Openeye Name: 4-(2-chloro-3-methyl-pentanoyl)oxybenzoate CAS Name: 4-(2-chloro-3-methyl-1-oxopentoxy)benzoate IUPAC Name: 4-(2-chloro-3-methylpentanoyl)oxybenzoate Traditional Name: 4-(2-chloro-3-methyl-pentanoyl)oxybenzoate Formula: C13H14ClO4- MolecularWeight: 269.70086

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC1=CC=C(C=C1)C(=O)[O-])Cl

Isomeric SMILES

CCC(C)C(C(=O)OC1=CC=C(C=C1)C(=O)[O-])Cl

InChI

InChI=1S/C13H15ClO4/c1-3-8(2)11(14)13(17)18-10-6-4-9(5-7-10)12(15)16/h4-8,11H,3H2,1-2H3,(H,15,16)/p-1