4-oxidanylidene-4-[2-(2-sulfanyl-2-adamantyl)ethoxy]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[2-(2-sulfanyl-2-adamantyl)ethoxy]butanoic acid Openeye Name: 4-oxo-4-[2-(2-sulfanyl-2-adamantyl)ethoxy]butanoic acid CAS Name: 4-[2-(2-mercapto-2-adamantyl)ethoxy]-4-oxobutanoic acid IUPAC Name: 4-oxo-4-[2-(2-sulfanyl-2-adamantyl)ethoxy]butanoic acid Traditional Name: 4-keto-4-[2-(2-mercapto-2-adamantyl)ethoxy]butyric acid Formula: C16H24O4S MolecularWeight: 312.42436

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3(CCOC(=O)CCC(=O)O)S

Isomeric SMILES

C1C2CC3CC1CC(C2)C3(CCOC(=O)CCC(=O)O)S

InChI

InChI=1S/C16H24O4S/c17-14(18)1-2-15(19)20-4-3-16(21)12-6-10-5-11(8-12)9-13(16)7-10/h10-13,21H,1-9H2,(H,17,18)