tert-butyl (E)-4,6-dimethyl-5-oxidanylidene-hept-2-enoate

Systemtic Name: tert-butyl (E)-4,6-dimethyl-5-oxidanylidene-hept-2-enoate Openeye Name: tert-butyl (E)-4,6-dimethyl-5-oxo-hept-2-enoate CAS Name: (E)-4,6-dimethyl-5-oxo-2-heptenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-4,6-dimethyl-5-oxohept-2-enoate Traditional Name: (E)-5-keto-4,6-dimethyl-hept-2-enoic acid tert-butyl ester Formula: C13H22O3 MolecularWeight: 226.31198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C(C)C=CC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C(=O)C(C)/C=C/C(=O)OC(C)(C)C

InChI

InChI=1S/C13H22O3/c1-9(2)12(15)10(3)7-8-11(14)16-13(4,5)6/h7-10H,1-6H3/b8-7+