2,2-dimethyl-3-(1-methylpiperidin-4-yl)-3-nitrooxy-propanoic acid

Systemtic Name: 2,2-dimethyl-3-(1-methylpiperidin-4-yl)-3-nitrooxy-propanoic acid Openeye Name: 2,2-dimethyl-3-(1-methyl-4-piperidyl)-3-nitrooxy-propanoic acid CAS Name: 2,2-dimethyl-3-(1-methyl-4-piperidinyl)-3-nitrooxypropanoic acid IUPAC Name: 2,2-dimethyl-3-(1-methylpiperidin-4-yl)-3-nitrooxypropanoic acid Traditional Name: 2,2-dimethyl-3-(1-methyl-4-piperidyl)-3-nitrooxy-propionic acid Formula: C11H20N2O5 MolecularWeight: 260.2869

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C1CCN(CC1)C)O[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(C)(C(C1CCN(CC1)C)O[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C11H20N2O5/c1-11(2,10(14)15)9(18-13(16)17)8-4-6-12(3)7-5-8/h8-9H,4-7H2,1-3H3,(H,14,15)