tert-butyl (2E)-4-methyl-5-oxidanylidene-2-(phenylmethylidene)hexanoate

Systemtic Name: tert-butyl (2E)-4-methyl-5-oxidanylidene-2-(phenylmethylidene)hexanoate Openeye Name: tert-butyl (2E)-2-benzylidene-4-methyl-5-oxo-hexanoate CAS Name: (2E)-4-methyl-5-oxo-2-(phenylmethylene)hexanoic acid tert-butyl ester IUPAC Name: tert-butyl (2E)-2-benzylidene-4-methyl-5-oxohexanoate Traditional Name: (E)-2-(3-keto-2-methyl-butyl)-3-phenyl-acrylic acid tert-butyl ester Formula: C18H24O3 MolecularWeight: 288.38136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C/C(=C\C1=CC=CC=C1)/C(=O)OC(C)(C)C)C(=O)C

InChI

InChI=1S/C18H24O3/c1-13(14(2)19)11-16(17(20)21-18(3,4)5)12-15-9-7-6-8-10-15/h6-10,12-13H,11H2,1-5H3/b16-12+