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

Systemtic Name: 2-chloranyl-2-(3,5-dimethyl-1-adamantyl)ethanoic acid Openeye Name: 2-chloro-2-(3,5-dimethyl-1-adamantyl)acetic acid CAS Name: 2-chloro-2-(3,5-dimethyl-1-adamantyl)acetic acid IUPAC Name: 2-chloro-2-(3,5-dimethyl-1-adamantyl)acetic acid Traditional Name: 2-chloro-2-(3,5-dimethyl-1-adamantyl)acetic acid Formula: C14H21ClO2 MolecularWeight: 256.76834

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)C(C(=O)O)Cl)C

Isomeric SMILES

CC12CC3CC(C1)(CC(C3)(C2)C(C(=O)O)Cl)C

InChI

InChI=1S/C14H21ClO2/c1-12-3-9-4-13(2,6-12)8-14(5-9,7-12)10(15)11(16)17/h9-10H,3-8H2,1-2H3,(H,16,17)