[(4R,5E)-hepta-1,5-dien-4-yl] (2S)-2-acetyloxy-2-phenyl-ethanoate

Systemtic Name: [(4R,5E)-hepta-1,5-dien-4-yl] (2S)-2-acetyloxy-2-phenyl-ethanoate Openeye Name: [(E,1R)-1-allylbut-2-enyl] (2S)-2-acetoxy-2-phenyl-acetate CAS Name: (2S)-2-acetyloxy-2-phenylacetic acid [(4R,5E)-hepta-1,5-dien-4-yl] ester IUPAC Name: [(4R,5E)-hepta-1,5-dien-4-yl] (2S)-2-acetyloxy-2-phenylacetate Traditional Name: (2S)-2-acetoxy-2-phenyl-acetic acid [(E,1R)-1-allylbut-2-enyl] ester Formula: C17H20O4 MolecularWeight: 288.3383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20O4/c1-4-9-15(10-5-2)21-17(19)16(20-13(3)18)14-11-7-6-8-12-14/h4-8,10-12,15-16H,1,9H2,2-3H3/b10-5+/t15-,16+/m1/s1