methyl 4-ethanoyl-5-oxidanylidene-4-phenethyl-hexanoate

Systemtic Name: methyl 4-ethanoyl-5-oxidanylidene-4-phenethyl-hexanoate Openeye Name: methyl 4-acetyl-5-oxo-4-phenethyl-hexanoate CAS Name: 4-acetyl-5-oxo-4-phenethylhexanoic acid methyl ester IUPAC Name: methyl 4-acetyl-5-oxo-4-phenethylhexanoate Traditional Name: 4-acetyl-5-keto-4-phenethyl-hexanoic acid methyl ester Formula: C17H22O4 MolecularWeight: 290.35418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22O4/c1-13(18)17(14(2)19,12-10-16(20)21-3)11-9-15-7-5-4-6-8-15/h4-8H,9-12H2,1-3H3