2-ethylhexyl 3-oxidanylidene-3-phenyl-propanoate

Systemtic Name: 2-ethylhexyl 3-oxidanylidene-3-phenyl-propanoate Openeye Name: 2-ethylhexyl 3-oxo-3-phenyl-propanoate CAS Name: 3-oxo-3-phenylpropanoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl 3-oxo-3-phenylpropanoate Traditional Name: 3-keto-3-phenyl-propionic acid 2-ethylhexyl ester Formula: C17H24O3 MolecularWeight: 276.37066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)CC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCC(CC)COC(=O)CC(=O)C1=CC=CC=C1

InChI

InChI=1S/C17H24O3/c1-3-5-9-14(4-2)13-20-17(19)12-16(18)15-10-7-6-8-11-15/h6-8,10-11,14H,3-5,9,12-13H2,1-2H3