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

Systemtic Name: 4-[2-(2-nitrososulfanyl-2-adamantyl)ethoxy]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-(2-nitrososulfanyl-2-adamantyl)ethoxy]-4-oxo-butanoic acid CAS Name: 4-[2-[2-(nitrosothio)-2-adamantyl]ethoxy]-4-oxobutanoic acid IUPAC Name: 4-[2-(2-nitrososulfanyl-2-adamantyl)ethoxy]-4-oxobutanoic acid Traditional Name: 4-keto-4-[2-[2-(nitrosothio)-2-adamantyl]ethoxy]butyric acid Formula: C16H23NO5S MolecularWeight: 341.42252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO5S/c18-14(19)1-2-15(20)22-4-3-16(23-17-21)12-6-10-5-11(8-12)9-13(16)7-10/h10-13H,1-9H2,(H,18,19)