2-acetamido-2-(4-nitrososulfanyloxan-4-yl)ethanoic acid

Systemtic Name: 2-acetamido-2-(4-nitrososulfanyloxan-4-yl)ethanoic acid Openeye Name: 2-acetamido-2-(4-nitrososulfanyltetrahydropyran-4-yl)acetic acid CAS Name: 2-acetamido-2-[4-(nitrosothio)-4-oxanyl]acetic acid IUPAC Name: 2-acetamido-2-(4-nitrososulfanyloxan-4-yl)acetic acid Traditional Name: 2-acetamido-2-[4-(nitrosothio)tetrahydropyran-4-yl]acetic acid Formula: C9H14N2O5S MolecularWeight: 262.28286

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C(=O)O)C1(CCOCC1)SN=O

Isomeric SMILES

CC(=O)NC(C(=O)O)C1(CCOCC1)SN=O

InChI

InChI=1S/C9H14N2O5S/c1-6(12)10-7(8(13)14)9(17-11-15)2-4-16-5-3-9/h7H,2-5H2,1H3,(H,10,12)(H,13,14)