(E)-3-[2,2,3-tris[(E)-3-oxidanidyl-3-oxidanylidene-prop-1-enyl]-1-adamantyl]prop-2-enoate

Systemtic Name: (E)-3-[2,2,3-tris[(E)-3-oxidanidyl-3-oxidanylidene-prop-1-enyl]-1-adamantyl]prop-2-enoate Openeye Name: (E)-3-[2,2,3-tris[(E)-3-oxido-3-oxo-prop-1-enyl]-1-adamantyl]prop-2-enoate CAS Name: (E)-3-[2,2,3-tris[(E)-3-oxido-3-oxoprop-1-enyl]-1-adamantyl]-2-propenoate IUPAC Name: (E)-3-[2,2,3-tris[(E)-3-oxido-3-oxoprop-1-enyl]-1-adamantyl]prop-2-enoate Traditional Name: (E)-3-[2,2,3-tris[(E)-3-keto-3-oxido-prop-1-enyl]-1-adamantyl]acrylate Formula: C22H20O8-4 MolecularWeight: 412.3894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3(C=CC(=O)[O-])C=CC(=O)[O-])C=CC(=O)[O-])C=CC(=O)[O-]

Isomeric SMILES

C1C2CC3(C(C(C2)(CC1C3)/C=C/C(=O)[O-])(/C=C/C(=O)[O-])/C=C/C(=O)[O-])/C=C/C(=O)[O-]

InChI

InChI=1S/C22H24O8/c23-16(24)1-5-20-10-14-9-15(11-20)13-21(12-14,6-2-17(25)26)22(20,7-3-18(27)28)8-4-19(29)30/h1-8,14-15H,9-13H2,(H,23,24)(H,25,26)(H,27,28)(H,29,30)/p-4/b5-1+,6-2+,7-3+,8-4+