2-[3-(carboxymethyl)-5,7-dimethyl-1-adamantyl]-2-chloranyl-ethanoic acid

Systemtic Name: 2-[3-(carboxymethyl)-5,7-dimethyl-1-adamantyl]-2-chloranyl-ethanoic acid Openeye Name: 2-[3-(carboxymethyl)-5,7-dimethyl-1-adamantyl]-2-chloro-acetic acid CAS Name: 2-[3-(carboxymethyl)-5,7-dimethyl-1-adamantyl]-2-chloroacetic acid IUPAC Name: 2-[3-(carboxymethyl)-5,7-dimethyl-1-adamantyl]-2-chloroacetic acid Traditional Name: 2-[3-(carboxymethyl)-5,7-dimethyl-1-adamantyl]-2-chloro-acetic acid Formula: C16H23ClO4 MolecularWeight: 314.80442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23ClO4/c1-13-4-14(2)6-15(5-13,3-10(18)19)9-16(7-13,8-14)11(17)12(20)21/h11H,3-9H2,1-2H3,(H,18,19)(H,20,21)