[(Z)-1,1,1-trideuterio-5-oxidanylidene-4-phenyl-hex-2-en-2-yl] 2,2,2-trideuterioethanoate

Systemtic Name: [(Z)-1,1,1-trideuterio-5-oxidanylidene-4-phenyl-hex-2-en-2-yl] 2,2,2-trideuterioethanoate Openeye Name: [(Z)-4-oxo-3-phenyl-1-(trideuteriomethyl)pent-1-enyl] 2,2,2-trideuterioacetate CAS Name: 2,2,2-trideuterioacetic acid [(Z)-1,1,1-trideuterio-5-oxo-4-phenylhex-2-en-2-yl] ester IUPAC Name: [(Z)-1,1,1-trideuterio-5-oxo-4-phenylhex-2-en-2-yl] 2,2,2-trideuterioacetate Traditional Name: 2,2,2-trideuterioacetic acid [(Z)-4-keto-3-phenyl-1-(trideuteriomethyl)pent-1-enyl] ester Formula: C14H16O3 MolecularWeight: 238.312011

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

[2H]C([2H])([2H])/C(=C/C(C1=CC=CC=C1)C(=O)C)/OC(=O)C([2H])([2H])[2H]

InChI

InChI=1S/C14H16O3/c1-10(17-12(3)16)9-14(11(2)15)13-7-5-4-6-8-13/h4-9,14H,1-3H3/b10-9-/i1D3,3D3