methyl (Z)-4-ethyl-4-oxidanyl-3-(phenylcarbonyl)hex-2-enoate

Systemtic Name: methyl (Z)-4-ethyl-4-oxidanyl-3-(phenylcarbonyl)hex-2-enoate Openeye Name: methyl (Z)-3-benzoyl-4-ethyl-4-hydroxy-hex-2-enoate CAS Name: (Z)-3-benzoyl-4-ethyl-4-hydroxy-2-hexenoic acid methyl ester IUPAC Name: methyl (Z)-3-benzoyl-4-ethyl-4-hydroxyhex-2-enoate Traditional Name: (Z)-3-benzoyl-4-ethyl-4-hydroxy-hex-2-enoic acid methyl ester Formula: C16H20O4 MolecularWeight: 276.3276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20O4/c1-4-16(19,5-2)13(11-14(17)20-3)15(18)12-9-7-6-8-10-12/h6-11,19H,4-5H2,1-3H3/b13-11+