3-[4-(2-nitrooxyethyl)piperazin-1-yl]propyl 2-oxidanylidenepropanoate

Systemtic Name: 3-[4-(2-nitrooxyethyl)piperazin-1-yl]propyl 2-oxidanylidenepropanoate Openeye Name: 3-[4-(2-nitrooxyethyl)piperazin-1-yl]propyl 2-oxopropanoate CAS Name: 2-oxopropanoic acid 3-[4-(2-nitrooxyethyl)-1-piperazinyl]propyl ester IUPAC Name: 3-[4-(2-nitrooxyethyl)piperazin-1-yl]propyl 2-oxopropanoate Traditional Name: 2-ketopropionic acid 3-[4-(2-nitrooxyethyl)piperazino]propyl ester Formula: C12H21N3O6 MolecularWeight: 303.31164

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=O)OCCCN1CCN(CC1)CCO[N+](=O)[O-]

Isomeric SMILES

CC(=O)C(=O)OCCCN1CCN(CC1)CCO[N+](=O)[O-]

InChI

InChI=1S/C12H21N3O6/c1-11(16)12(17)20-9-2-3-13-4-6-14(7-5-13)8-10-21-15(18)19/h2-10H2,1H3