[(E)-2-[4-(1-adamantyl)-3-(1-methoxyethoxymethoxy)phenyl]ethenyl] benzoate

Systemtic Name: [(E)-2-[4-(1-adamantyl)-3-(1-methoxyethoxymethoxy)phenyl]ethenyl] benzoate Openeye Name: [(E)-2-[4-(1-adamantyl)-3-(1-methoxyethoxymethoxy)phenyl]vinyl] benzoate CAS Name: benzoic acid [(E)-2-[4-(1-adamantyl)-3-(1-methoxyethoxymethoxy)phenyl]ethenyl] ester IUPAC Name: [(E)-2-[4-(1-adamantyl)-3-(1-methoxyethoxymethoxy)phenyl]ethenyl] benzoate Traditional Name: benzoic acid [(E)-2-[4-(1-adamantyl)-3-(1-methoxyethoxymethoxy)phenyl]vinyl] ester Formula: C29H34O5 MolecularWeight: 462.57726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(OC)OCOC1=C(C=CC(=C1)C=COC(=O)C2=CC=CC=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(OC)OCOC1=C(C=CC(=C1)/C=C/OC(=O)C2=CC=CC=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C29H34O5/c1-20(31-2)33-19-34-27-15-21(10-11-32-28(30)25-6-4-3-5-7-25)8-9-26(27)29-16-22-12-23(17-29)14-24(13-22)18-29/h3-11,15,20,22-24H,12-14,16-19H2,1-2H3/b11-10+