3-bromanyl-5,7-dimethyl-adamantane-1-carboxylic acid

Systemtic Name: 3-bromanyl-5,7-dimethyl-adamantane-1-carboxylic acid Openeye Name: 3-bromo-5,7-dimethyl-adamantane-1-carboxylic acid CAS Name: 3-bromo-5,7-dimethyl-1-adamantanecarboxylic acid IUPAC Name: 3-bromo-5,7-dimethyladamantane-1-carboxylic acid Traditional Name: 3-bromo-5,7-dimethyl-adamantane-1-carboxylic acid Formula: C13H19BrO2 MolecularWeight: 287.19276

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3(CC(C1)(CC(C2)(C3)Br)C(=O)O)C

Isomeric SMILES

CC12CC3(CC(C1)(CC(C2)(C3)Br)C(=O)O)C

InChI

InChI=1S/C13H19BrO2/c1-10-3-11(2)5-12(4-10,9(15)16)8-13(14,6-10)7-11/h3-8H2,1-2H3,(H,15,16)