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

Systemtic Name: methyl 2-acetamido-2-(1-methyl-4-nitrososulfanyl-piperidin-4-yl)ethanoate hydrochloride Openeye Name: methyl 2-acetamido-2-(1-methyl-4-nitrososulfanyl-4-piperidyl)acetate hydrochloride CAS Name: 2-acetamido-2-[1-methyl-4-(nitrosothio)-4-piperidinyl]acetic acid methyl ester hydrochloride IUPAC Name: methyl 2-acetamido-2-(1-methyl-4-nitrososulfanylpiperidin-4-yl)acetate hydrochloride Traditional Name: 2-acetamido-2-[1-methyl-4-(nitrosothio)-4-piperidyl]acetic acid methyl ester hydrochloride Formula: C11H20ClN3O4S MolecularWeight: 325.8122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C(=O)OC)C1(CCN(CC1)C)SN=O.Cl

Isomeric SMILES

CC(=O)NC(C(=O)OC)C1(CCN(CC1)C)SN=O.Cl

InChI

InChI=1S/C11H19N3O4S.ClH/c1-8(15)12-9(10(16)18-3)11(19-13-17)4-6-14(2)7-5-11;/h9H,4-7H2,1-3H3,(H,12,15);1H