3-bromanyl-5-methyl-adamantane-1-carboxylate

Systemtic Name: 3-bromanyl-5-methyl-adamantane-1-carboxylate Openeye Name: 3-bromo-5-methyl-adamantane-1-carboxylate CAS Name: 3-bromo-5-methyl-1-adamantanecarboxylate IUPAC Name: 3-bromo-5-methyladamantane-1-carboxylate Traditional Name: 3-bromo-5-methyl-adamantane-1-carboxylate Formula: C12H16BrO2- MolecularWeight: 272.15824

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)Br)C(=O)[O-]

Isomeric SMILES

CC12CC3CC(C1)(CC(C3)(C2)Br)C(=O)[O-]

InChI

InChI=1S/C12H17BrO2/c1-10-2-8-3-11(5-10,9(14)15)7-12(13,4-8)6-10/h8H,2-7H2,1H3,(H,14,15)/p-1