[(E,2R)-4-phenylbut-3-en-2-yl] 3-oxidanylidenebutanoate

Systemtic Name: [(E,2R)-4-phenylbut-3-en-2-yl] 3-oxidanylidenebutanoate Openeye Name: [(E,1R)-1-methyl-3-phenyl-allyl] 3-oxobutanoate CAS Name: 3-oxobutanoic acid [(E,2R)-4-phenylbut-3-en-2-yl] ester IUPAC Name: [(E,2R)-4-phenylbut-3-en-2-yl] 3-oxobutanoate Traditional Name: 3-ketobutyric acid [(E,1R)-1-methyl-3-phenyl-allyl] ester Formula: C14H16O3 MolecularWeight: 232.27504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C=CC1=CC=CC=C1)OC(=O)CC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C14H16O3/c1-11(15)10-14(16)17-12(2)8-9-13-6-4-3-5-7-13/h3-9,12H,10H2,1-2H3/b9-8+/t12-/m1/s1