2-(1-adamantyl)propan-2-yl (E)-3-phenylprop-2-enoate

Systemtic Name: 2-(1-adamantyl)propan-2-yl (E)-3-phenylprop-2-enoate Openeye Name: [1-(1-adamantyl)-1-methyl-ethyl] (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid 2-(1-adamantyl)propan-2-yl ester IUPAC Name: 2-(1-adamantyl)propan-2-yl (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid [1-(1-adamantyl)-1-methyl-ethyl] ester Formula: C22H28O2 MolecularWeight: 324.45652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C12CC3CC(C1)CC(C3)C2)OC(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C12CC3CC(C1)CC(C3)C2)OC(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C22H28O2/c1-21(2,24-20(23)9-8-16-6-4-3-5-7-16)22-13-17-10-18(14-22)12-19(11-17)15-22/h3-9,17-19H,10-15H2,1-2H3/b9-8+