(3-tert-butylcyclohexen-1-yl)methyl 3-oxidanylidenepentanoate

Systemtic Name: (3-tert-butylcyclohexen-1-yl)methyl 3-oxidanylidenepentanoate Openeye Name: (3-tert-butylcyclohexen-1-yl)methyl 3-oxopentanoate CAS Name: 3-oxopentanoic acid (3-tert-butyl-1-cyclohexenyl)methyl ester IUPAC Name: (3-tert-butylcyclohexen-1-yl)methyl 3-oxopentanoate Traditional Name: 3-ketovaleric acid (3-tert-butylcyclohexen-1-yl)methyl ester Formula: C16H26O3 MolecularWeight: 266.37584

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC(=O)OCC1=CC(CCC1)C(C)(C)C

Isomeric SMILES

CCC(=O)CC(=O)OCC1=CC(CCC1)C(C)(C)C

InChI

InChI=1S/C16H26O3/c1-5-14(17)10-15(18)19-11-12-7-6-8-13(9-12)16(2,3)4/h9,13H,5-8,10-11H2,1-4H3