methyl 4-(5-methyl-4-oxidanylidene-hexyl)benzoate

Systemtic Name: methyl 4-(5-methyl-4-oxidanylidene-hexyl)benzoate Openeye Name: methyl 4-(5-methyl-4-oxo-hexyl)benzoate CAS Name: 4-(5-methyl-4-oxohexyl)benzoic acid methyl ester IUPAC Name: methyl 4-(5-methyl-4-oxohexyl)benzoate Traditional Name: 4-(4-keto-5-methyl-hexyl)benzoic acid methyl ester Formula: C15H20O3 MolecularWeight: 248.3175

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)CCCC1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

CC(C)C(=O)CCCC1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C15H20O3/c1-11(2)14(16)6-4-5-12-7-9-13(10-8-12)15(17)18-3/h7-11H,4-6H2,1-3H3