3-(1-hydroxyethyl)adamantane-1-carboxylic acid

Systemtic Name: 3-(1-hydroxyethyl)adamantane-1-carboxylic acid Openeye Name: 3-(1-hydroxyethyl)adamantane-1-carboxylic acid CAS Name: 3-(1-hydroxyethyl)-1-adamantanecarboxylic acid IUPAC Name: 3-(1-hydroxyethyl)adamantane-1-carboxylic acid Traditional Name: 3-(1-hydroxyethyl)adamantane-1-carboxylic acid Formula: C13H20O3 MolecularWeight: 224.2961

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)(C2)C(=O)O)O

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)(C2)C(=O)O)O

InChI

InChI=1S/C13H20O3/c1-8(14)12-3-9-2-10(4-12)6-13(5-9,7-12)11(15)16/h8-10,14H,2-7H2,1H3,(H,15,16)