methyl 5-(2-methylphenyl)-4-oxidanylidene-pentanoate

Systemtic Name: methyl 5-(2-methylphenyl)-4-oxidanylidene-pentanoate Openeye Name: methyl 5-(o-tolyl)-4-oxo-pentanoate CAS Name: 5-(2-methylphenyl)-4-oxopentanoic acid methyl ester IUPAC Name: methyl 5-(2-methylphenyl)-4-oxopentanoate Traditional Name: 4-keto-5-(o-tolyl)valeric acid methyl ester Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)CCC(=O)OC

Isomeric SMILES

CC1=CC=CC=C1CC(=O)CCC(=O)OC

InChI

InChI=1S/C13H16O3/c1-10-5-3-4-6-11(10)9-12(14)7-8-13(15)16-2/h3-6H,7-9H2,1-2H3