methyl 4-(2-methoxy-5-methyl-phenyl)-5-oxidanylidene-pentanoate

Systemtic Name: methyl 4-(2-methoxy-5-methyl-phenyl)-5-oxidanylidene-pentanoate Openeye Name: methyl 4-(2-methoxy-5-methyl-phenyl)-5-oxo-pentanoate CAS Name: 4-(2-methoxy-5-methylphenyl)-5-oxopentanoic acid methyl ester IUPAC Name: methyl 4-(2-methoxy-5-methylphenyl)-5-oxopentanoate Traditional Name: 5-keto-4-(2-methoxy-5-methyl-phenyl)valeric acid methyl ester Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18O4/c1-10-4-6-13(17-2)12(8-10)11(9-15)5-7-14(16)18-3/h4,6,8-9,11H,5,7H2,1-3H3