2-[3-(carboxymethyl)-5-methyl-1-adamantyl]-2-chloranyl-ethanoic acid

Systemtic Name: 2-[3-(carboxymethyl)-5-methyl-1-adamantyl]-2-chloranyl-ethanoic acid Openeye Name: 2-[3-(carboxymethyl)-5-methyl-1-adamantyl]-2-chloro-acetic acid CAS Name: 2-[3-(carboxymethyl)-5-methyl-1-adamantyl]-2-chloroacetic acid IUPAC Name: 2-[3-(carboxymethyl)-5-methyl-1-adamantyl]-2-chloroacetic acid Traditional Name: 2-[3-(carboxymethyl)-5-methyl-1-adamantyl]-2-chloro-acetic acid Formula: C15H21ClO4 MolecularWeight: 300.77784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21ClO4/c1-13-2-9-3-14(6-13,5-10(17)18)8-15(4-9,7-13)11(16)12(19)20/h9,11H,2-8H2,1H3,(H,17,18)(H,19,20)