1-adamantyl anthracene-9-carboxylate

Systemtic Name: 1-adamantyl anthracene-9-carboxylate Openeye Name: 1-adamantyl anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid 1-adamantyl ester IUPAC Name: 1-adamantyl anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid 1-adamantyl ester Formula: C25H24O2 MolecularWeight: 356.45686

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)OC(=O)C4=C5C=CC=CC5=CC6=CC=CC=C64

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)OC(=O)C4=C5C=CC=CC5=CC6=CC=CC=C64

InChI

InChI=1S/C25H24O2/c26-24(27-25-13-16-9-17(14-25)11-18(10-16)15-25)23-21-7-3-1-5-19(21)12-20-6-2-4-8-22(20)23/h1-8,12,16-18H,9-11,13-15H2