methyl 4,4-dideuterio-5-oxidanylidene-7-phenyl-heptanoate

Systemtic Name: methyl 4,4-dideuterio-5-oxidanylidene-7-phenyl-heptanoate Openeye Name: methyl 4,4-dideuterio-5-oxo-7-phenyl-heptanoate CAS Name: 4,4-dideuterio-5-oxo-7-phenylheptanoic acid methyl ester IUPAC Name: methyl 4,4-dideuterio-5-oxo-7-phenylheptanoate Traditional Name: 4,4-dideuterio-5-keto-7-phenyl-enanthic acid methyl ester Formula: C14H18O3 MolecularWeight: 236.303244

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(=O)CCC1=CC=CC=C1

Isomeric SMILES

[2H]C([2H])(CCC(=O)OC)C(=O)CCC1=CC=CC=C1

InChI

InChI=1S/C14H18O3/c1-17-14(16)9-5-8-13(15)11-10-12-6-3-2-4-7-12/h2-4,6-7H,5,8-11H2,1H3/i8D2