phenethyl (E)-3-[3,5-bis(3-methylbut-2-enyl)-4-oxidanyl-phenyl]prop-2-enoate

Systemtic Name: phenethyl (E)-3-[3,5-bis(3-methylbut-2-enyl)-4-oxidanyl-phenyl]prop-2-enoate Openeye Name: phenethyl (E)-3-[4-hydroxy-3,5-bis(3-methylbut-2-enyl)phenyl]prop-2-enoate CAS Name: (E)-3-[4-hydroxy-3,5-bis(3-methylbut-2-enyl)phenyl]-2-propenoic acid phenethyl ester IUPAC Name: phenethyl (E)-3-[4-hydroxy-3,5-bis(3-methylbut-2-enyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-hydroxy-3,5-bis(3-methylbut-2-enyl)phenyl]acrylic acid phenethyl ester Formula: C27H32O3 MolecularWeight: 404.54118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=CC(=CC(=C1O)CC=C(C)C)C=CC(=O)OCCC2=CC=CC=C2)C

Isomeric SMILES

CC(=CCC1=CC(=CC(=C1O)CC=C(C)C)/C=C/C(=O)OCCC2=CC=CC=C2)C

InChI

InChI=1S/C27H32O3/c1-20(2)10-13-24-18-23(19-25(27(24)29)14-11-21(3)4)12-15-26(28)30-17-16-22-8-6-5-7-9-22/h5-12,15,18-19,29H,13-14,16-17H2,1-4H3/b15-12+