6-nitrooxyhexyl 3-azanylidene-3-propan-2-yloxy-propanoate

Systemtic Name: 6-nitrooxyhexyl 3-azanylidene-3-propan-2-yloxy-propanoate Openeye Name: 6-nitrooxyhexyl 3-imino-3-isopropoxy-propanoate CAS Name: 3-imino-3-propan-2-yloxypropanoic acid 6-nitrooxyhexyl ester IUPAC Name: 6-nitrooxyhexyl 3-imino-3-propan-2-yloxypropanoate Traditional Name: 3-imino-3-isopropoxy-propionic acid 6-nitrooxyhexyl ester Formula: C12H22N2O6 MolecularWeight: 290.31288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=N)CC(=O)OCCCCCCO[N+](=O)[O-]

Isomeric SMILES

CC(C)OC(=N)CC(=O)OCCCCCCO[N+](=O)[O-]

InChI

InChI=1S/C12H22N2O6/c1-10(2)20-11(13)9-12(15)18-7-5-3-4-6-8-19-14(16)17/h10,13H,3-9H2,1-2H3