(4-prop-2-enoxycarbonylphenyl) 3-(1-adamantyl)-4-oxidanyl-benzoate

Systemtic Name: (4-prop-2-enoxycarbonylphenyl) 3-(1-adamantyl)-4-oxidanyl-benzoate Openeye Name: (4-allyloxycarbonylphenyl) 3-(1-adamantyl)-4-hydroxy-benzoate CAS Name: 3-(1-adamantyl)-4-hydroxybenzoic acid [4-[oxo(prop-2-enoxy)methyl]phenyl] ester IUPAC Name: (4-prop-2-enoxycarbonylphenyl) 3-(1-adamantyl)-4-hydroxybenzoate Traditional Name: 3-(1-adamantyl)-4-hydroxy-benzoic acid (4-allyloxycarbonylphenyl) ester Formula: C27H28O5 MolecularWeight: 432.50822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28O5/c1-2-9-31-25(29)20-3-6-22(7-4-20)32-26(30)21-5-8-24(28)23(13-21)27-14-17-10-18(15-27)12-19(11-17)16-27/h2-8,13,17-19,28H,1,9-12,14-16H2