2-acetamido-2-(1-methyl-4-nitrososulfanyl-piperidin-4-yl)ethanoic acid

Systemtic Name: 2-acetamido-2-(1-methyl-4-nitrososulfanyl-piperidin-4-yl)ethanoic acid Openeye Name: 2-acetamido-2-(1-methyl-4-nitrososulfanyl-4-piperidyl)acetic acid CAS Name: 2-acetamido-2-[1-methyl-4-(nitrosothio)-4-piperidinyl]acetic acid IUPAC Name: 2-acetamido-2-(1-methyl-4-nitrososulfanylpiperidin-4-yl)acetic acid Traditional Name: 2-acetamido-2-[1-methyl-4-(nitrosothio)-4-piperidyl]acetic acid Formula: C10H17N3O4S MolecularWeight: 275.32468

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C(=O)O)C1(CCN(CC1)C)SN=O

Isomeric SMILES

CC(=O)NC(C(=O)O)C1(CCN(CC1)C)SN=O

InChI

InChI=1S/C10H17N3O4S/c1-7(14)11-8(9(15)16)10(18-12-17)3-5-13(2)6-4-10/h8H,3-6H2,1-2H3,(H,11,14)(H,15,16)