2-(2-nitrososulfanyl-2-adamantyl)ethanoic acid

Systemtic Name: 2-(2-nitrososulfanyl-2-adamantyl)ethanoic acid Openeye Name: 2-(2-nitrososulfanyl-2-adamantyl)acetic acid CAS Name: 2-[2-(nitrosothio)-2-adamantyl]acetic acid IUPAC Name: 2-(2-nitrososulfanyl-2-adamantyl)acetic acid Traditional Name: 2-[2-(nitrosothio)-2-adamantyl]acetic acid Formula: C12H17NO3S MolecularWeight: 255.33328

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3(CC(=O)O)SN=O

Isomeric SMILES

C1C2CC3CC1CC(C2)C3(CC(=O)O)SN=O

InChI

InChI=1S/C12H17NO3S/c14-11(15)6-12(17-13-16)9-2-7-1-8(4-9)5-10(12)3-7/h7-10H,1-6H2,(H,14,15)