[2-(9H-fluoren-3-yl)-2-oxidanylidene-ethyl] 2-(3-bromanyl-1-adamantyl)ethanoate

Systemtic Name: [2-(9H-fluoren-3-yl)-2-oxidanylidene-ethyl] 2-(3-bromanyl-1-adamantyl)ethanoate Openeye Name: [2-(9H-fluoren-3-yl)-2-oxo-ethyl] 2-(3-bromo-1-adamantyl)acetate CAS Name: 2-(3-bromo-1-adamantyl)acetic acid [2-(9H-fluoren-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(9H-fluoren-3-yl)-2-oxoethyl] 2-(3-bromo-1-adamantyl)acetate Traditional Name: 2-(3-bromo-1-adamantyl)acetic acid [2-(9H-fluoren-3-yl)-2-keto-ethyl] ester Formula: C27H27BrO3 MolecularWeight: 479.40548

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Br)CC(=O)OCC(=O)C4=CC5=C(CC6=CC=CC=C65)C=C4

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)Br)CC(=O)OCC(=O)C4=CC5=C(CC6=CC=CC=C65)C=C4

InChI

InChI=1S/C27H27BrO3/c28-27-12-17-7-18(13-27)11-26(10-17,16-27)14-25(30)31-15-24(29)21-6-5-20-8-19-3-1-2-4-22(19)23(20)9-21/h1-6,9,17-18H,7-8,10-16H2