2-(3-bromanyl-5,7-dimethyl-1-adamantyl)ethanoic acid

Systemtic Name: 2-(3-bromanyl-5,7-dimethyl-1-adamantyl)ethanoic acid Openeye Name: 2-(3-bromo-5,7-dimethyl-1-adamantyl)acetic acid CAS Name: 2-(3-bromo-5,7-dimethyl-1-adamantyl)acetic acid IUPAC Name: 2-(3-bromo-5,7-dimethyl-1-adamantyl)acetic acid Traditional Name: 2-(3-bromo-5,7-dimethyl-1-adamantyl)acetic acid Formula: C14H21BrO2 MolecularWeight: 301.21934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21BrO2/c1-11-4-12(2)6-13(5-11,3-10(16)17)9-14(15,7-11)8-12/h3-9H2,1-2H3,(H,16,17)