methyl 3-oxidanylidene-2-phenethyl-hexanoate

Systemtic Name: methyl 3-oxidanylidene-2-phenethyl-hexanoate Openeye Name: methyl 3-oxo-2-phenethyl-hexanoate CAS Name: 3-oxo-2-phenethylhexanoic acid methyl ester IUPAC Name: methyl 3-oxo-2-phenethylhexanoate Traditional Name: 3-keto-2-phenethyl-hexanoic acid methyl ester Formula: C15H20O3 MolecularWeight: 248.3175

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(CCC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CCCC(=O)C(CCC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C15H20O3/c1-3-7-14(16)13(15(17)18-2)11-10-12-8-5-4-6-9-12/h4-6,8-9,13H,3,7,10-11H2,1-2H3