5-(2-methoxy-5-methyl-phenyl)-5-oxidanylidene-pentanoate

Systemtic Name: 5-(2-methoxy-5-methyl-phenyl)-5-oxidanylidene-pentanoate Openeye Name: 5-(2-methoxy-5-methyl-phenyl)-5-oxo-pentanoate CAS Name: 5-(2-methoxy-5-methylphenyl)-5-oxopentanoate IUPAC Name: 5-(2-methoxy-5-methylphenyl)-5-oxopentanoate Traditional Name: 5-keto-5-(2-methoxy-5-methyl-phenyl)valerate Formula: C13H15O4- MolecularWeight: 235.2558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O4/c1-9-6-7-12(17-2)10(8-9)11(14)4-3-5-13(15)16/h6-8H,3-5H2,1-2H3,(H,15,16)/p-1