[4-(2-nitrooxyethyl)piperazin-1-yl]methyl 2-oxidanylidenepropanoate

Systemtic Name: [4-(2-nitrooxyethyl)piperazin-1-yl]methyl 2-oxidanylidenepropanoate Openeye Name: [4-(2-nitrooxyethyl)piperazin-1-yl]methyl 2-oxopropanoate CAS Name: 2-oxopropanoic acid [4-(2-nitrooxyethyl)-1-piperazinyl]methyl ester IUPAC Name: [4-(2-nitrooxyethyl)piperazin-1-yl]methyl 2-oxopropanoate Traditional Name: 2-ketopropionic acid [4-(2-nitrooxyethyl)piperazino]methyl ester Formula: C10H17N3O6 MolecularWeight: 275.25848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=O)OCN1CCN(CC1)CCO[N+](=O)[O-]

Isomeric SMILES

CC(=O)C(=O)OCN1CCN(CC1)CCO[N+](=O)[O-]

InChI

InChI=1S/C10H17N3O6/c1-9(14)10(15)18-8-12-4-2-11(3-5-12)6-7-19-13(16)17/h2-8H2,1H3