ethyl 2-acetamido-2-(1-methyl-4-nitrososulfanyl-piperidin-4-yl)ethanoate

Systemtic Name: ethyl 2-acetamido-2-(1-methyl-4-nitrososulfanyl-piperidin-4-yl)ethanoate Openeye Name: ethyl 2-acetamido-2-(1-methyl-4-nitrososulfanyl-4-piperidyl)acetate CAS Name: 2-acetamido-2-[1-methyl-4-(nitrosothio)-4-piperidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-acetamido-2-(1-methyl-4-nitrososulfanylpiperidin-4-yl)acetate Traditional Name: 2-acetamido-2-[1-methyl-4-(nitrosothio)-4-piperidyl]acetic acid ethyl ester Formula: C12H21N3O4S MolecularWeight: 303.37784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H21N3O4S/c1-4-19-11(17)10(13-9(2)16)12(20-14-18)5-7-15(3)8-6-12/h10H,4-8H2,1-3H3,(H,13,16)