methyl (4E)-2-ethanoyl-5-oxidanylidene-4-(phenylmethylidene)hexanoate

Systemtic Name: methyl (4E)-2-ethanoyl-5-oxidanylidene-4-(phenylmethylidene)hexanoate Openeye Name: methyl (4E)-2-acetyl-4-benzylidene-5-oxo-hexanoate CAS Name: (4E)-2-acetyl-5-oxo-4-(phenylmethylene)hexanoic acid methyl ester IUPAC Name: methyl (4E)-2-acetyl-4-benzylidene-5-oxohexanoate Traditional Name: (E)-2,4-diacetyl-5-phenyl-pent-4-enoic acid methyl ester Formula: C16H18O4 MolecularWeight: 274.31172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18O4/c1-11(17)14(9-13-7-5-4-6-8-13)10-15(12(2)18)16(19)20-3/h4-9,15H,10H2,1-3H3/b14-9+