methyl 5-(4-methylphenyl)-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-(4-methylphenyl)-5-oxidanylidene-pentanoate Openeye Name: methyl 5-oxo-5-(p-tolyl)pentanoate CAS Name: 5-(4-methylphenyl)-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-(4-methylphenyl)-5-oxopentanoate Traditional Name: 5-keto-5-(p-tolyl)valeric acid methyl ester Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CCCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CCCC(=O)OC

InChI

InChI=1S/C13H16O3/c1-10-6-8-11(9-7-10)12(14)4-3-5-13(15)16-2/h6-9H,3-5H2,1-2H3