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(phenylmethyl) (2S)-2-ethanoyl-2-methyl-5-oxidanylidene-hexanoate

(phenylmethyl) (2S)-2-ethanoyl-2-methyl-5-oxidanylidene-hexanoate

Systemtic Name:(phenylmethyl) (2S)-2-ethanoyl-2-methyl-5-oxidanylidene-hexanoate
Openeye Name:benzyl (2S)-2-acetyl-2-methyl-5-oxo-hexanoate
CAS Name:(2S)-2-acetyl-2-methyl-5-oxohexanoic acid (phenylmethyl) ester
IUPAC Name:benzyl (2S)-2-acetyl-2-methyl-5-oxohexanoate
Traditional Name:(2S)-2-acetyl-5-keto-2-methyl-hexanoic acid benzyl ester
Formula: C16H20O4
MolecularWeight: 276.3276
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(C)(C(=O)C)C(=O)OCC1=CC=CC=C1


Isomeric SMILES

CC(=O)CC[C@@](C)(C(=O)C)C(=O)OCC1=CC=CC=C1


InChI

InChI=1S/C16H20O4/c1-12(17)9-10-16(3,13(2)18)15(19)20-11-14-7-5-4-6-8-14/h4-8H,9-11H2,1-3H3/t16-/m0/s1


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