[(E)-3-(3-ethynylphenyl)prop-2-enyl] 3-oxidanylidenebutanoate

Systemtic Name: [(E)-3-(3-ethynylphenyl)prop-2-enyl] 3-oxidanylidenebutanoate Openeye Name: [(E)-3-(3-ethynylphenyl)allyl] 3-oxobutanoate CAS Name: 3-oxobutanoic acid [(E)-3-(3-ethynylphenyl)prop-2-enyl] ester IUPAC Name: [(E)-3-(3-ethynylphenyl)prop-2-enyl] 3-oxobutanoate Traditional Name: 3-ketobutyric acid [(E)-3-(3-ethynylphenyl)allyl] ester Formula: C15H14O3 MolecularWeight: 242.26986

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)OCC=CC1=CC=CC(=C1)C#C

Isomeric SMILES

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

InChI

InChI=1S/C15H14O3/c1-3-13-6-4-7-14(11-13)8-5-9-18-15(17)10-12(2)16/h1,4-8,11H,9-10H2,2H3/b8-5+