[2,4,6-tris(bromanyl)phenyl] adamantane-1-carboxylate

Systemtic Name: [2,4,6-tris(bromanyl)phenyl] adamantane-1-carboxylate Openeye Name: (2,4,6-tribromophenyl) adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid (2,4,6-tribromophenyl) ester IUPAC Name: (2,4,6-tribromophenyl) adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid (2,4,6-tribromophenyl) ester Formula: C17H17Br3O2 MolecularWeight: 493.02768

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)OC4=C(C=C(C=C4Br)Br)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)OC4=C(C=C(C=C4Br)Br)Br

InChI

InChI=1S/C17H17Br3O2/c18-12-4-13(19)15(14(20)5-12)22-16(21)17-6-9-1-10(7-17)3-11(2-9)8-17/h4-5,9-11H,1-3,6-8H2